2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione

C293H181F10N5O20S16 — CID 164951310

About 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione

2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione (PubChem CID 164951310) has the molecular formula C293H181F10N5O20S16 and a molecular weight of 4794.74 g/mol. Its IUPAC name is 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione.

Molecular Properties

• Compound Name: 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione
• PubChem CID: 164951310
• Molecular Formula: C293H181F10N5O20S16
• Molecular Weight: 4794.74 g/mol
• Exact Mass: 4789.87
• IUPAC Name: 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione
• SMILES: CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(/C=C3\C(=O)C(=O)c5ccc(C(F)(F)F)cc53)cc21)C(C)(C)c1cc(/C=C2\C(=O)C(=O)c3ccc(C(F)(F)F)cc32)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5cc(C#N)c(C#N)cc5C3=O)cc21)C(C)(C)c1cc(/C=C2\C(=O)c3cc(C#N)c(C#N)nc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5cc6cc(F)c(F)cc6cc5C3=O)cc21)C(C)(C)c1cc(C=C2C(=O)c3cc5cc(F)c(F)cc5cc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5cc6cc7ccccc7cc6cc5C3=O)cc21)C(C)(C)c1cc(C=C2C(=O)c3cc5cc6ccccc6cc5cc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5ccccc5C3=O)cc21)C(C)(C)c1cc(C=C2C(=O)c3ccccc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=S)c5ccccc5C3=S)cc21)C(C)(C)c1cc(C=C2C(=S)c3ccccc3C2=S)sc14
• InChI: InChI=1S/C60H38O4S2.C52H30F4O4S2.C47H25N5O4S2.C46H28F6O4S2.C44H30O4S2.C44H30S6/c1-59(2)49-23-37-22-46-50(60(3,4)52-28-40(66-58(46)52)26-48-55(63)43-19-35-15-31-11-7-8-12-32(31)16-36(35)20-44(43)56(48)64)24-38(37)21-45(49)57-51(59)27-39(65-57)25-47-53(61)41-17-33-13-29-9-5-6-10-30(29)14-34(33)18-42(41)54(47)62;1-51(2)37-11-21-10-34-38(52(3,4)40-20-28(62-50(34)40)18-36-47(59)31-7-25-15-43(55)44(56)16-26(25)8-32(31)48(36)60)12-22(21)9-33(37)49-39(51)19-27(61-49)17-35-45(57)29-5-23-13-41(53)42(54)14-24(23)6-30(29)46(35)58;1-46(2)34-10-21-6-30-35(47(3,4)37-15-26(58-45(30)37)13-33-42(55)31-9-24(18-50)38(19-51)52-39(31)43(33)56)11-20(21)5-29(34)44-36(46)14-25(57-44)12-32-40(53)27-7-22(16-48)23(17-49)8-28(27)41(32)54;1-43(2)33-11-19-10-32-34(44(3,4)36-18-24(58-42(32)36)16-30-28-14-22(46(50,51)52)6-8-26(28)38(54)40(30)56)12-20(19)9-31(33)41-35(43)17-23(57-41)15-29-27-13-21(45(47,48)49)5-7-25(27)37(53)39(29)55;2*1-43(2)33-15-21-14-30-34(44(3,4)36-20-24(50-42(30)36)18-32-39(47)27-11-7-8-12-28(27)40(32)48)16-22(21)13-29(33)41-35(43)19-23(49-41)17-31-37(45)25-9-5-6-10-26(25)38(31)46/h5-28,37-38H,1-4H3;5-22H,1-4H3;5-15,20-21H,1-4H3;5-20H,1-4H3;2*5-22H,1-4H3/b;;33-13+;29-15-,30-16-
• InChIKey: AOMVJNVPRXJDAR-XDMVHKJHSA-N
• XLogP: 69.60
• TPSA: 449.45 Ų
• H-Bond Acceptors: 41
• Rotatable Bonds: 12
• Heavy Atoms: 344
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4794.74
LogP ≤ 5	69.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?

The IUPAC name of 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione (CID 164951310) is 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione.

What is the SMILES notation for 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?

The canonical SMILES for 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione is CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(/C=C3\C(=O)C(=O)c5ccc(C(F)(F)F)cc53)cc21)C(C)(C)c1cc(/C=C2\C(=O)C(=O)c3ccc(C(F)(F)F)cc32)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5cc(C#N)c(C#N)cc5C3=O)cc21)C(C)(C)c1cc(/C=C2\C(=O)c3cc(C#N)c(C#N)nc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5cc6cc(F)c(F)cc6cc5C3=O)cc21)C(C)(C)c1cc(C=C2C(=O)c3cc5cc(F)c(F)cc5cc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5cc6cc7ccccc7cc6cc5C3=O)cc21)C(C)(C)c1cc(C=C2C(=O)c3cc5cc6ccccc6cc5cc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=O)c5ccccc5C3=O)cc21)C(C)(C)c1cc(C=C2C(=O)c3ccccc3C2=O)sc14.CC1(C)C2=CC3C=C4C(=CC3C=C2c2sc(C=C3C(=S)c5ccccc5C3=S)cc21)C(C)(C)c1cc(C=C2C(=S)c3ccccc3C2=S)sc14.

What is the InChIKey of 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?

The InChIKey is AOMVJNVPRXJDAR-XDMVHKJHSA-N. The full InChI is InChI=1S/C60H38O4S2.C52H30F4O4S2.C47H25N5O4S2.C46H28F6O4S2.C44H30O4S2.C44H30S6/c1-59(2)49-23-37-22-46-50(60(3,4)52-28-40(66-58(46)52)26-48-55(63)43-19-35-15-31-11-7-8-12-32(31)16-36(35)20-44(43)56(48)64)24-38(37)21-45(49)57-51(59)27-39(65-57)25-47-53(61)41-17-33-13-29-9-5-6-10-30(29)14-34(33)18-42(41)54(47)62;1-51(2)37-11-21-10-34-38(52(3,4)40-20-28(62-50(34)40)18-36-47(59)31-7-25-15-43(55)44(56)16-26(25)8-32(31)48(36)60)12-22(21)9-33(37)49-39(51)19-27(61-49)17-35-45(57)29-5-23-13-41(53)42(54)14-24(23)6-30(29)46(35)58;1-46(2)34-10-21-6-30-35(47(3,4)37-15-26(58-45(30)37)13-33-42(55)31-9-24(18-50)38(19-51)52-39(31)43(33)56)11-20(21)5-29(34)44-36(46)14-25(57-44)12-32-40(53)27-7-22(16-48)23(17-49)8-28(27)41(32)54;1-43(2)33-11-19-10-32-34(44(3,4)36-18-24(58-42(32)36)16-30-28-14-22(46(50,51)52)6-8-26(28)38(54)40(30)56)12-20(19)9-31(33)41-35(43)17-23(57-41)15-29-27-13-21(45(47,48)49)5-7-25(27)37(53)39(29)55;2*1-43(2)33-15-21-14-30-34(44(3,4)36-20-24(50-42(30)36)18-32-39(47)27-11-7-8-12-28(27)40(32)48)16-22(21)13-29(33)41-35(43)19-23(49-41)17-31-37(45)25-9-5-6-10-26(25)38(31)46/h5-28,37-38H,1-4H3;5-22H,1-4H3;5-15,20-21H,1-4H3;5-20H,1-4H3;2*5-22H,1-4H3/b;;33-13+;29-15-,30-16-;;.

What are the key properties of 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?

2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione has a molecular weight of 4794.74 g/mol, XLogP of 69.60, 12 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[17-[[1,3-bis(sulfanylidene)inden-2-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dithione;(6E)-6-[[17-[(5,6-dicyano-1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5,7-dioxocyclopenta[b]pyridine-2,3-dicarbonitrile;2-[[17-[(6,7-difluoro-1,3-dioxocyclopenta[b]naphthalen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-6,7-difluorocyclopenta[b]naphthalene-1,3-dione;2-[[17-[(1,3-dioxocyclopenta[b]anthracen-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]cyclopenta[b]anthracene-1,3-dione;2-[[17-[(1,3-dioxoinden-2-ylidene)methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]indene-1,3-dione;(3Z)-3-[[17-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-9,9,20,20-tetramethyl-5,16-dithiahexacyclo[10.10.0.03,10.04,8.014,21.015,19]docosa-2,4(8),6,10,13,15(19),17,21-octaen-6-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione is sourced from PubChem (CID 164951310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).