About N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane)
N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane) (PubChem CID 164956282) has the molecular formula C218H132F6N28O18S20
and a molecular weight of 4186.96 g/mol. Its IUPAC name is N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane).
Frequently Asked Questions
What is the IUPAC name of N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane)?
The IUPAC name of N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane) (CID 164956282) is N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane).
What is the SMILES notation for N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane)?
The canonical SMILES for N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane) is CC.CC.CC(F)(F)F.CC(F)(F)F.CC1=CC2c3sc(C=C4C(=O)c5ccccc5C4=O)cc3C(C)=CC2c2sc(C=C3C(=O)c4ccccc4C3=O)cc21.CC1=CC2c3sc(C=C4C(=O)c5ccccc5C4=O)nc3C(C)=CC2c2sc(C=C3C(=O)c4ccccc4C3=O)nc21.Cn1c2cc(/C=C3\C(=O)C(=O)c4ccccc43)sc2c2sc3cc(/C=C4\C(=O)C(=O)c5ccccc54)sc3c21.Cn1c2cc(C=C3C(=O)c4ccccc4C3=O)sc2c2sc3cc(C=C4C(=O)c5ccccc5C4=O)sc3c21.[C-]#[N+]C(C#N)=Nc1cc(OC)c(-c2nc3c(s2)C2C=C(C)c4nc(-c5sc(N=C(C#N)[N+]#[C-])cc5OC)sc4C2C=C3C)s1.[C-]#[N+]C(C#N)=Nc1ccc(-c2nc3c(s2)C2C=C(C)c4nc(-c5ccc(N=C(C#N)[N+]#[C-])s5)sc4C2C=C3C)s1.[C-]#[N+]C(C#N)=Nc1nc2c(s1)C1C=C(C)c3nc(N=C(C#N)[N+]#[C-])sc3C1C=C2C.
What is the InChIKey of N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane)?
The InChIKey is BFEUUIHLCCPHSB-VFDHASCRSA-N. The full InChI is InChI=1S/C36H22O4S2.C34H20N2O4S2.2C31H15NO4S3.C30H18N8O2S4.C28H14N8S4.C20H10N8S2.2C2H3F3.2C2H6/c1-17-11-27-28(35-25(17)13-19(41-35)15-29-31(37)21-7-3-4-8-22(21)32(29)38)12-18(2)26-14-20(42-36(26)27)16-30-33(39)23-9-5-6-10-24(23)34(30)40;1-15-11-21-22(33-27(15)35-25(41-33)13-23-29(37)17-7-3-4-8-18(17)30(23)38)12-16(2)28-34(21)42-26(36-28)14-24-31(39)19-9-5-6-10-20(19)32(24)40;1-32-22-12-14(10-20-16-6-2-4-8-18(16)25(33)27(20)35)37-29(22)31-24(32)30-23(39-31)13-15(38-30)11-21-17-7-3-5-9-19(17)26(34)28(21)36;1-32-22-12-14(10-20-25(33)16-6-2-3-7-17(16)26(20)34)37-29(22)31-24(32)30-23(39-31)13-15(38-30)11-21-27(35)18-8-4-5-9-19(18)28(21)36;1-13-7-15-16(25-23(13)37-29(43-25)27-17(39-5)9-21(41-27)35-19(11-31)33-3)8-14(2)24-26(15)44-30(38-24)28-18(40-6)10-22(42-28)36-20(12-32)34-4;1-13-9-15-16(25-23(13)35-27(39-25)17-5-7-21(37-17)33-19(11-29)31-3)10-14(2)24-26(15)40-28(36-24)18-6-8-22(38-18)34-20(12-30)32-4;1-9-5-11-12(17-15(9)27-19(29-17)25-13(7-21)23-3)6-10(2)16-18(11)30-20(28-16)26-14(8-22)24-4;2*1-2(3,4)5;2*1-2/h3-16,27-28H,1-2H3;3-14,21-22H,1-2H3;2*2-13H,1H3;7-10,15-16H,1-2,5-6H3;5-10,15-16H,1-2H3;5-6,11-12H,1-2H3;2*1H3;2*1-2H3/b;;20-10-,21-11-;;;;;;;;.
What are the key properties of N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane)?
N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane) has a molecular weight of 4186.96 g/mol, XLogP of 58.40, 20 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[cyano(isocyano)methylidene]amino]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]-3-methoxythiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]-4-methoxythiophen-2-yl]-1-isocyanomethanimidoyl cyanide;N-[5-[2-[5-[[cyano(isocyano)methylidene]amino]thiophen-2-yl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]thiophen-2-yl]-1-isocyanomethanimidoyl cyanide;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1,3]benzothiazolo[7,6-g][1,3]benzothiazol-7-yl]methylidene]indene-1,3-dione;2-[[2-[(1,3-dioxoinden-2-ylidene)methyl]-5,10-dimethyl-3b,8b-dihydro-[1]benzothiolo[7,6-g][1]benzothiol-7-yl]methylidene]indene-1,3-dione;2-[[4-[(1,3-dioxoinden-2-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,3-dione;(3Z)-3-[[4-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-14-methyl-3,7,10-trithia-14-azatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-11-yl]methylidene]indene-1,2-dione;ethane;bis(1,1,1-trifluoroethane) is sourced from PubChem (CID 164956282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).