4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene

C260H228N36S4 — CID 157065666

IUPAC4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene
SMILESCC(C)C1=NC=C(c2ccc3cc(-c4ccc5c6c(c7cnccc7c5c4)N=C(C(C)C)C6)sc3c2)C1.CC(C)C1=NC=C(c2ccc3cc(-c4ccc5c6c(c7cnncc7c5c4)N=C(C(C)C)C6)sc3c2)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5c4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5c4)cc3c3cnncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5n4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5n4)cc3c3cnncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)sc5c4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)sc5c4)cc3c3cnncc23)C1
InChIInChI=1S/C34H30N4.2C33H29N5.C33H29N3S.C32H28N6.2C32H28N4S.C31H27N5S/c1-19(2)31-16-29-26-10-9-24(15-28(26)27-11-12-35-17-30(27)33(29)37-31)22-5-6-23-14-25(8-7-21(23)13-22)32-18-36-34(38-32)20(3)4;1-18(2)30-15-26-23-8-5-22(14-25(23)24-11-12-34-16-27(24)32(26)37-30)29-9-6-20-13-21(7-10-28(20)36-29)31-17-35-33(38-31)19(3)4;1-18(2)30-14-27-25-10-9-23(13-26(25)28-15-35-36-16-29(28)32(27)37-30)21-5-6-22-12-24(8-7-20(22)11-21)31-17-34-33(38-31)19(3)4;1-18(2)29-12-23(16-35-29)20-5-6-22-14-32(37-31(22)13-20)21-7-8-24-26(11-21)25-9-10-34-17-28(25)33-27(24)15-30(36-33)19(3)4;1-17(2)29-13-24-22-8-5-21(12-23(22)25-14-34-35-15-26(25)31(24)37-29)28-9-6-19-11-20(7-10-27(19)36-28)30-16-33-32(38-30)18(3)4;1-17(2)28-10-22(14-33-28)19-5-6-21-12-31(37-30(21)11-19)20-7-8-23-24(9-20)26-15-34-35-16-27(26)32-25(23)13-29(36-32)18(3)4;1-17(2)27-14-25-22-8-7-19(11-24(22)23-9-10-33-15-26(23)31(25)35-27)20-5-6-21-13-30(37-29(21)12-20)28-16-34-32(36-28)18(3)4;1-16(2)26-12-23-21-8-7-18(9-22(21)24-13-33-34-14-25(24)30(23)35-26)19-5-6-20-11-29(37-28(20)10-19)27-15-32-31(36-27)17(3)4/h5-15,17-20H,16H2,1-4H3,(H,36,38);5-14,16-19H,15H2,1-4H3,(H,35,38);5-13,15-19H,14H2,1-4H3,(H,34,38);5-11,13-14,16-19H,12,15H2,1-4H3;5-12,14-18H,13H2,1-4H3,(H,33,38);5-9,11-12,14-18H,10,13H2,1-4H3;5-13,15-18H,14H2,1-4H3,(H,34,36);5-11,13-17H,12H2,1-4H3,(H,32,36)
InChIKeyABVQEWMFXOXZOM-UHFFFAOYSA-N
MW3985.20 g/mol
LogP69.32
Rot. Bonds32

About 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene

4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene (PubChem CID 157065666) has the molecular formula C260H228N36S4 and a molecular weight of 3985.20 g/mol. Its IUPAC name is 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene.

Molecular Properties

Compound Name4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene
PubChem CID157065666
Molecular FormulaC260H228N36S4
Molecular Weight3985.20 g/mol
Exact Mass3981.78
IUPAC Name4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene
SMILESCC(C)C1=NC=C(c2ccc3cc(-c4ccc5c6c(c7cnccc7c5c4)N=C(C(C)C)C6)sc3c2)C1.CC(C)C1=NC=C(c2ccc3cc(-c4ccc5c6c(c7cnncc7c5c4)N=C(C(C)C)C6)sc3c2)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5c4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5c4)cc3c3cnncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5n4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5n4)cc3c3cnncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)sc5c4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)sc5c4)cc3c3cnncc23)C1
InChIInChI=1S/C34H30N4.2C33H29N5.C33H29N3S.C32H28N6.2C32H28N4S.C31H27N5S/c1-19(2)31-16-29-26-10-9-24(15-28(26)27-11-12-35-17-30(27)33(29)37-31)22-5-6-23-14-25(8-7-21(23)13-22)32-18-36-34(38-32)20(3)4;1-18(2)30-15-26-23-8-5-22(14-25(23)24-11-12-34-16-27(24)32(26)37-30)29-9-6-20-13-21(7-10-28(20)36-29)31-17-35-33(38-31)19(3)4;1-18(2)30-14-27-25-10-9-23(13-26(25)28-15-35-36-16-29(28)32(27)37-30)21-5-6-22-12-24(8-7-20(22)11-21)31-17-34-33(38-31)19(3)4;1-18(2)29-12-23(16-35-29)20-5-6-22-14-32(37-31(22)13-20)21-7-8-24-26(11-21)25-9-10-34-17-28(25)33-27(24)15-30(36-33)19(3)4;1-17(2)29-13-24-22-8-5-21(12-23(22)25-14-34-35-15-26(25)31(24)37-29)28-9-6-19-11-20(7-10-27(19)36-28)30-16-33-32(38-30)18(3)4;1-17(2)28-10-22(14-33-28)19-5-6-21-12-31(37-30(21)11-19)20-7-8-23-24(9-20)26-15-34-35-16-27(26)32-25(23)13-29(36-32)18(3)4;1-17(2)27-14-25-22-8-7-19(11-24(22)23-9-10-33-15-26(23)31(25)35-27)20-5-6-21-13-30(37-29(21)12-20)28-16-34-32(36-28)18(3)4;1-16(2)26-12-23-21-8-7-18(9-22(21)24-13-33-34-14-25(24)30(23)35-26)19-5-6-20-11-29(37-28(20)10-19)27-15-32-31(36-27)17(3)4/h5-15,17-20H,16H2,1-4H3,(H,36,38);5-14,16-19H,15H2,1-4H3,(H,35,38);5-13,15-19H,14H2,1-4H3,(H,34,38);5-11,13-14,16-19H,12,15H2,1-4H3;5-12,14-18H,13H2,1-4H3,(H,33,38);5-9,11-12,14-18H,10,13H2,1-4H3;5-13,15-18H,14H2,1-4H3,(H,34,36);5-11,13-17H,12H2,1-4H3,(H,32,36)
InChIKeyABVQEWMFXOXZOM-UHFFFAOYSA-N
XLogP69.32
TPSA476.14 Ų
H-Bond Donors6
H-Bond Acceptors34
Rotatable Bonds32
Heavy Atoms300
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003985.20
LogP ≤ 569.32
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1034

Analyze 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene?
The IUPAC name of 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene (CID 157065666) is 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene.
What is the SMILES notation for 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene?
The canonical SMILES for 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene is CC(C)C1=NC=C(c2ccc3cc(-c4ccc5c6c(c7cnccc7c5c4)N=C(C(C)C)C6)sc3c2)C1.CC(C)C1=NC=C(c2ccc3cc(-c4ccc5c6c(c7cnncc7c5c4)N=C(C(C)C)C6)sc3c2)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5c4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5c4)cc3c3cnncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5n4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)ccc5n4)cc3c3cnncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)sc5c4)cc3c3ccncc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5cc(-c6cnc(C(C)C)[nH]6)sc5c4)cc3c3cnncc23)C1.
What is the InChIKey of 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene?
The InChIKey is ABVQEWMFXOXZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H30N4.2C33H29N5.C33H29N3S.C32H28N6.2C32H28N4S.C31H27N5S/c1-19(2)31-16-29-26-10-9-24(15-28(26)27-11-12-35-17-30(27)33(29)37-31)22-5-6-23-14-25(8-7-21(23)13-22)32-18-36-34(38-32)20(3)4;1-18(2)30-15-26-23-8-5-22(14-25(23)24-11-12-34-16-27(24)32(26)37-30)29-9-6-20-13-21(7-10-28(20)36-29)31-17-35-33(38-31)19(3)4;1-18(2)30-14-27-25-10-9-23(13-26(25)28-15-35-36-16-29(28)32(27)37-30)21-5-6-22-12-24(8-7-20(22)11-21)31-17-34-33(38-31)19(3)4;1-18(2)29-12-23(16-35-29)20-5-6-22-14-32(37-31(22)13-20)21-7-8-24-26(11-21)25-9-10-34-17-28(25)33-27(24)15-30(36-33)19(3)4;1-17(2)29-13-24-22-8-5-21(12-23(22)25-14-34-35-15-26(25)31(24)37-29)28-9-6-19-11-20(7-10-27(19)36-28)30-16-33-32(38-30)18(3)4;1-17(2)28-10-22(14-33-28)19-5-6-21-12-31(37-30(21)11-19)20-7-8-23-24(9-20)26-15-34-35-16-27(26)32-25(23)13-29(36-32)18(3)4;1-17(2)27-14-25-22-8-7-19(11-24(22)23-9-10-33-15-26(23)31(25)35-27)20-5-6-21-13-30(37-29(21)12-20)28-16-34-32(36-28)18(3)4;1-16(2)26-12-23-21-8-7-18(9-22(21)24-13-33-34-14-25(24)30(23)35-26)19-5-6-20-11-29(37-28(20)10-19)27-15-32-31(36-27)17(3)4/h5-15,17-20H,16H2,1-4H3,(H,36,38);5-14,16-19H,15H2,1-4H3,(H,35,38);5-13,15-19H,14H2,1-4H3,(H,34,38);5-11,13-14,16-19H,12,15H2,1-4H3;5-12,14-18H,13H2,1-4H3,(H,33,38);5-9,11-12,14-18H,10,13H2,1-4H3;5-13,15-18H,14H2,1-4H3,(H,34,36);5-11,13-17H,12H2,1-4H3,(H,32,36).
What are the key properties of 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene?
4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene has a molecular weight of 3985.20 g/mol, XLogP of 69.32, 32 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[2-(2-propan-2-yl-1H-imidazol-5-yl)-1-benzothiophen-6-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)naphthalen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-1H-imidazol-5-yl)quinolin-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,16-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaene;4-propan-2-yl-10-[6-(2-propan-2-yl-3H-pyrrol-4-yl)-1-benzothiophen-2-yl]-3,15,16-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaene is sourced from PubChem (CID 157065666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).