[3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate

C300H332O59S30 — CID 161203874

IUPAC[3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate
SMILESC=CC(=O)OC(COC(=O)C1SCCS1)COc1ccc(Oc2ccc(OCC(COC(=O)C3SCCS3)OC(=O)C=C)cc2)cc1.C=CC(=O)OC(COCCSC)COc1ccc(Oc2ccc(OCC(COCCSC)OC(=O)C=C)cc2)cc1.C=CC(=O)OC(COc1ccc(C(C)(C)c2ccc(C(C)(C)c3ccc(OCC(CSc4ccccc4)OC(=O)C=C)cc3)cc2)cc1)CSc1ccccc1.C=CC(=O)OC(COc1ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(OCC(CSc4ccccc4)OC(=O)C=C)cc3)c2)cc1)CSc1ccccc1.C=CC(=O)OC(COc1ccc(C(C)(c2ccccc2)c2ccc(OCC(CSCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSCCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSc3ccccc3)OC(=O)C=C)cc2)cc1)CSc1ccccc1
InChIInChI=1S/2C48H50O6S2.C40H46O6S6.C36H34O7S2.C34H42O7S6.C32H34O11S4.C32H38O7S6.C30H38O9S2/c1-7-45(49)53-41(33-55-43-18-11-9-12-19-43)31-51-39-26-22-35(23-27-39)47(3,4)37-16-15-17-38(30-37)48(5,6)36-24-28-40(29-25-36)52-32-42(54-46(50)8-2)34-56-44-20-13-10-14-21-44;1-7-45(49)53-41(33-55-43-15-11-9-12-16-43)31-51-39-27-23-37(24-28-39)47(3,4)35-19-21-36(22-20-35)48(5,6)38-25-29-40(30-26-38)52-32-42(54-46(50)8-2)34-56-44-17-13-10-14-18-44;1-4-36(41)45-34(25-47-27-38-49-19-20-50-38)23-43-32-15-11-30(12-16-32)40(3,29-9-7-6-8-10-29)31-13-17-33(18-14-31)44-24-35(46-37(42)5-2)26-48-28-39-51-21-22-52-39;1-3-35(37)42-31(25-44-33-11-7-5-8-12-33)23-39-27-15-19-29(20-16-27)41-30-21-17-28(18-22-30)40-24-32(43-36(38)4-2)26-45-34-13-9-6-10-14-34;1-3-31(35)40-29(23-42-15-13-33-44-17-18-45-33)21-37-25-5-9-27(10-6-25)39-28-11-7-26(8-12-28)38-22-30(41-32(36)4-2)24-43-16-14-34-46-19-20-47-34;1-3-27(33)42-25(19-39-29(35)31-44-13-14-45-31)17-37-21-5-9-23(10-6-21)41-24-11-7-22(8-12-24)38-18-26(43-28(34)4-2)20-40-30(36)32-46-15-16-47-32;1-3-29(33)38-27(19-40-21-31-42-13-14-43-31)17-35-23-5-9-25(10-6-23)37-26-11-7-24(8-12-26)36-18-28(39-30(34)4-2)20-41-22-32-44-15-16-45-32;1-5-29(31)38-27(19-33-15-17-40-3)21-35-23-7-11-25(12-8-23)37-26-13-9-24(10-14-26)36-22-28(39-30(32)6-2)20-34-16-18-41-4/h2*7-30,41-42H,1-2,31-34H2,3-6H3;4-18,34-35,38-39H,1-2,19-28H2,3H3;3-22,31-32H,1-2,23-26H2;3-12,29-30,33-34H,1-2,13-24H2;3-12,25-26,31-32H,1-2,13-20H2;3-12,27-28,31-32H,1-2,13-22H2;5-14,27-28H,1-2,15-22H2,3-4H3
InChIKeyUVINXLYWPLBMFI-UHFFFAOYSA-N
MW5843.91 g/mol
LogP64.97
Rot. Bonds161

About [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate

[3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate (PubChem CID 161203874) has the molecular formula C300H332O59S30 and a molecular weight of 5843.91 g/mol. Its IUPAC name is [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate.

Molecular Properties

Compound Name[3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate
PubChem CID161203874
Molecular FormulaC300H332O59S30
Molecular Weight5843.91 g/mol
Exact Mass5837.46
IUPAC Name[3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate
SMILESC=CC(=O)OC(COC(=O)C1SCCS1)COc1ccc(Oc2ccc(OCC(COC(=O)C3SCCS3)OC(=O)C=C)cc2)cc1.C=CC(=O)OC(COCCSC)COc1ccc(Oc2ccc(OCC(COCCSC)OC(=O)C=C)cc2)cc1.C=CC(=O)OC(COc1ccc(C(C)(C)c2ccc(C(C)(C)c3ccc(OCC(CSc4ccccc4)OC(=O)C=C)cc3)cc2)cc1)CSc1ccccc1.C=CC(=O)OC(COc1ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(OCC(CSc4ccccc4)OC(=O)C=C)cc3)c2)cc1)CSc1ccccc1.C=CC(=O)OC(COc1ccc(C(C)(c2ccccc2)c2ccc(OCC(CSCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSCCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSc3ccccc3)OC(=O)C=C)cc2)cc1)CSc1ccccc1
InChIInChI=1S/2C48H50O6S2.C40H46O6S6.C36H34O7S2.C34H42O7S6.C32H34O11S4.C32H38O7S6.C30H38O9S2/c1-7-45(49)53-41(33-55-43-18-11-9-12-19-43)31-51-39-26-22-35(23-27-39)47(3,4)37-16-15-17-38(30-37)48(5,6)36-24-28-40(29-25-36)52-32-42(54-46(50)8-2)34-56-44-20-13-10-14-21-44;1-7-45(49)53-41(33-55-43-15-11-9-12-16-43)31-51-39-27-23-37(24-28-39)47(3,4)35-19-21-36(22-20-35)48(5,6)38-25-29-40(30-26-38)52-32-42(54-46(50)8-2)34-56-44-17-13-10-14-18-44;1-4-36(41)45-34(25-47-27-38-49-19-20-50-38)23-43-32-15-11-30(12-16-32)40(3,29-9-7-6-8-10-29)31-13-17-33(18-14-31)44-24-35(46-37(42)5-2)26-48-28-39-51-21-22-52-39;1-3-35(37)42-31(25-44-33-11-7-5-8-12-33)23-39-27-15-19-29(20-16-27)41-30-21-17-28(18-22-30)40-24-32(43-36(38)4-2)26-45-34-13-9-6-10-14-34;1-3-31(35)40-29(23-42-15-13-33-44-17-18-45-33)21-37-25-5-9-27(10-6-25)39-28-11-7-26(8-12-28)38-22-30(41-32(36)4-2)24-43-16-14-34-46-19-20-47-34;1-3-27(33)42-25(19-39-29(35)31-44-13-14-45-31)17-37-21-5-9-23(10-6-21)41-24-11-7-22(8-12-24)38-18-26(43-28(34)4-2)20-40-30(36)32-46-15-16-47-32;1-3-29(33)38-27(19-40-21-31-42-13-14-43-31)17-35-23-5-9-25(10-6-23)37-26-11-7-24(8-12-26)36-18-28(39-30(34)4-2)20-41-22-32-44-15-16-45-32;1-5-29(31)38-27(19-33-15-17-40-3)21-35-23-7-11-25(12-8-23)37-26-13-9-24(10-14-26)36-22-28(39-30(32)6-2)20-34-16-18-41-4/h2*7-30,41-42H,1-2,31-34H2,3-6H3;4-18,34-35,38-39H,1-2,19-28H2,3H3;3-22,31-32H,1-2,23-26H2;3-12,29-30,33-34H,1-2,13-24H2;3-12,25-26,31-32H,1-2,13-20H2;3-12,27-28,31-32H,1-2,13-22H2;5-14,27-28H,1-2,15-22H2,3-4H3
InChIKeyUVINXLYWPLBMFI-UHFFFAOYSA-N
XLogP64.97
TPSA685.69 Ų
H-Bond Donors
H-Bond Acceptors89
Rotatable Bonds161
Heavy Atoms389
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005843.91
LogP ≤ 564.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1089

Analyze [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate with MolForge

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What is the IUPAC name of [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate?
The IUPAC name of [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate (CID 161203874) is [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate.
What is the SMILES notation for [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate?
The canonical SMILES for [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate is C=CC(=O)OC(COC(=O)C1SCCS1)COc1ccc(Oc2ccc(OCC(COC(=O)C3SCCS3)OC(=O)C=C)cc2)cc1.C=CC(=O)OC(COCCSC)COc1ccc(Oc2ccc(OCC(COCCSC)OC(=O)C=C)cc2)cc1.C=CC(=O)OC(COc1ccc(C(C)(C)c2ccc(C(C)(C)c3ccc(OCC(CSc4ccccc4)OC(=O)C=C)cc3)cc2)cc1)CSc1ccccc1.C=CC(=O)OC(COc1ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(OCC(CSc4ccccc4)OC(=O)C=C)cc3)c2)cc1)CSc1ccccc1.C=CC(=O)OC(COc1ccc(C(C)(c2ccccc2)c2ccc(OCC(CSCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSCCC3SCCS3)OC(=O)C=C)cc2)cc1)CSCCC1SCCS1.C=CC(=O)OC(COc1ccc(Oc2ccc(OCC(CSc3ccccc3)OC(=O)C=C)cc2)cc1)CSc1ccccc1.
What is the InChIKey of [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate?
The InChIKey is UVINXLYWPLBMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H50O6S2.C40H46O6S6.C36H34O7S2.C34H42O7S6.C32H34O11S4.C32H38O7S6.C30H38O9S2/c1-7-45(49)53-41(33-55-43-18-11-9-12-19-43)31-51-39-26-22-35(23-27-39)47(3,4)37-16-15-17-38(30-37)48(5,6)36-24-28-40(29-25-36)52-32-42(54-46(50)8-2)34-56-44-20-13-10-14-21-44;1-7-45(49)53-41(33-55-43-15-11-9-12-16-43)31-51-39-27-23-37(24-28-39)47(3,4)35-19-21-36(22-20-35)48(5,6)38-25-29-40(30-26-38)52-32-42(54-46(50)8-2)34-56-44-17-13-10-14-18-44;1-4-36(41)45-34(25-47-27-38-49-19-20-50-38)23-43-32-15-11-30(12-16-32)40(3,29-9-7-6-8-10-29)31-13-17-33(18-14-31)44-24-35(46-37(42)5-2)26-48-28-39-51-21-22-52-39;1-3-35(37)42-31(25-44-33-11-7-5-8-12-33)23-39-27-15-19-29(20-16-27)41-30-21-17-28(18-22-30)40-24-32(43-36(38)4-2)26-45-34-13-9-6-10-14-34;1-3-31(35)40-29(23-42-15-13-33-44-17-18-45-33)21-37-25-5-9-27(10-6-25)39-28-11-7-26(8-12-28)38-22-30(41-32(36)4-2)24-43-16-14-34-46-19-20-47-34;1-3-27(33)42-25(19-39-29(35)31-44-13-14-45-31)17-37-21-5-9-23(10-6-21)41-24-11-7-22(8-12-24)38-18-26(43-28(34)4-2)20-40-30(36)32-46-15-16-47-32;1-3-29(33)38-27(19-40-21-31-42-13-14-43-31)17-35-23-5-9-25(10-6-23)37-26-11-7-24(8-12-26)36-18-28(39-30(34)4-2)20-41-22-32-44-15-16-45-32;1-5-29(31)38-27(19-33-15-17-40-3)21-35-23-7-11-25(12-8-23)37-26-13-9-24(10-14-26)36-22-28(39-30(32)6-2)20-34-16-18-41-4/h2*7-30,41-42H,1-2,31-34H2,3-6H3;4-18,34-35,38-39H,1-2,19-28H2,3H3;3-22,31-32H,1-2,23-26H2;3-12,29-30,33-34H,1-2,13-24H2;3-12,25-26,31-32H,1-2,13-20H2;3-12,27-28,31-32H,1-2,13-22H2;5-14,27-28H,1-2,15-22H2,3-4H3.
What are the key properties of [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate?
[3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate has a molecular weight of 5843.91 g/mol, XLogP of 64.97, 161 rotatable bonds, 0 hydrogen bond donors, and 89 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[4-[4-[3-(1,3-dithiolane-2-carbonyloxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]-2-prop-2-enoyloxypropyl] 1,3-dithiolane-2-carboxylate;[1-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-3-[4-[4-[3-[2-(1,3-dithiolan-2-yl)ethylsulfanyl]-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-(1,3-dithiolan-2-ylmethylsulfanyl)-3-[4-[1-[4-[3-(1,3-dithiolan-2-ylmethylsulfanyl)-2-prop-2-enoyloxypropoxy]phenyl]-1-phenylethyl]phenoxy]propan-2-yl] prop-2-enoate;[1-(2-methylsulfanylethoxy)-3-[4-[4-[3-(2-methylsulfanylethoxy)-2-prop-2-enoyloxypropoxy]phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenoxy]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[3-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate;[1-phenylsulfanyl-3-[4-[2-[4-[2-[4-(3-phenylsulfanyl-2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]phenoxy]propan-2-yl] prop-2-enoate is sourced from PubChem (CID 161203874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).