4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine

C268H276N20O8S9Si4 — CID 165063716

About 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine

4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine (PubChem CID 165063716) has the molecular formula C268H276N20O8S9Si4 and a molecular weight of 4306.23 g/mol. Its IUPAC name is 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine.

Molecular Properties

• Compound Name: 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine
• PubChem CID: 165063716
• Molecular Formula: C268H276N20O8S9Si4
• Molecular Weight: 4306.23 g/mol
• Exact Mass: 4301.84
• IUPAC Name: 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine
• SMILES: CCN(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)c1ccc(N(c2ccc(N(C)C)cc2)c2cc3sc(/C=C/c4ccc(/C=C/C5=C(C#N)/C(=C(\C)C#N)OC5(C)c5ccccc5)s4)cc3s2)cc1.[C-]#[N+]C1=C(/C=C/C=C2/C=C(/C=C/c3cc4sc(N(c5ccc(N(C)C)cc5)c5ccc(N(C)C)cc5)cc4s3)CC(C)(C)C2)C(C)(c2ccccc2)O/C1=C(\C)[N+]#[C-].[C-]#[N+]C1=C(/C=C/C=C2/C=C(/C=C/c3cc4sc(N(c5ccc(N(C)C)cc5)c5ccc(N(CC)CCO[Si](c6ccccc6)(c6ccccc6)C(C)(C)C)cc5)cc4s3)CC(C)(C)C2)C(C)(c2ccccc2)O/C1=C(\C)[N+]#[C-].[C-]#[N+]C1=C(/C=C/C=C2\CC(C)(C)CC(/C=C/c3cc4sc(N(c5ccc(N(C)C)cc5)c5ccc(N(CC)CCO[Si](c6ccccc6)(c6ccccc6)C(C)(C)C)cc5)cc4s3)=C2CCCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C(C)(c2ccccc2)O/C1=C(\C)[N+]#[C-]
• InChI: InChI=1S/C87H95N5O3S2Si2.C68H71N5O2S2Si.C63H61N5O2S3Si.C50H49N5OS2/c1-16-91(57-59-94-99(85(6,7)8,75-41-28-20-29-42-75)76-43-30-21-31-44-76)69-50-54-71(55-51-69)92(70-52-48-68(49-53-70)90(14)15)81-61-80-79(97-81)60-72(96-80)56-47-66-63-86(9,10)62-65(34-32-46-78-82(89-13)83(64(2)88-12)95-87(78,11)67-35-22-17-23-36-67)77(66)45-33-58-93-98(84(3,4)5,73-37-24-18-25-38-73)74-39-26-19-27-40-74;1-13-72(42-43-74-78(66(3,4)5,58-27-19-15-20-28-58)59-29-21-16-22-30-59)54-35-39-56(40-36-54)73(55-37-33-53(34-38-55)71(11)12)63-46-62-61(77-63)45-57(76-62)41-32-51-44-50(47-67(6,7)48-51)24-23-31-60-64(70-10)65(49(2)69-9)75-68(60,8)52-25-17-14-18-26-52;1-9-67(39-40-69-74(62(3,4)5,54-21-15-11-16-22-54)55-23-17-12-18-24-55)48-27-31-50(32-28-48)68(49-29-25-47(26-30-49)66(7)8)60-42-59-58(73-60)41-53(72-59)36-35-51-33-34-52(71-51)37-38-57-56(44-65)61(45(2)43-64)70-63(57,6)46-19-13-10-14-20-46;1-34(51-5)48-47(52-6)43(50(4,56-48)37-16-12-11-13-17-37)18-14-15-35-29-36(33-49(2,3)32-35)19-28-42-30-44-45(57-42)31-46(58-44)55(40-24-20-38(21-25-40)53(7)8)41-26-22-39(23-27-41)54(9)10/h17-32,34-44,46-56,60-61H,16,33,45,57-59,62-63H2,1-11,14-15H3;14-41,44-46H,13,42-43,47-48H2,1-8,11-12H3;10-38,41-42H,9,39-40H2,1-8H3;11-31H,32-33H2,1-4,7-10H3/b46-32+,56-47+,65-34+,83-64+;31-23+,41-32+,50-24-,65-49+;36-35+,38-37+,61-45-;18-14+,28-19+,35-15-,48-34+
• InChIKey: RPVBPRMBZOOEJX-WMHANULYSA-N
• XLogP: 68.34
• TPSA: 186.46 Ų
• H-Bond Acceptors: 31
• Rotatable Bonds: 68
• Heavy Atoms: 309
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4306.23
LogP ≤ 5	68.34
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine?

The IUPAC name of 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine (CID 165063716) is 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine.

What is the SMILES notation for 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine?

The canonical SMILES for 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine is CCN(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)c1ccc(N(c2ccc(N(C)C)cc2)c2cc3sc(/C=C/c4ccc(/C=C/C5=C(C#N)/C(=C(\C)C#N)OC5(C)c5ccccc5)s4)cc3s2)cc1.[C-]#[N+]C1=C(/C=C/C=C2/C=C(/C=C/c3cc4sc(N(c5ccc(N(C)C)cc5)c5ccc(N(C)C)cc5)cc4s3)CC(C)(C)C2)C(C)(c2ccccc2)O/C1=C(\C)[N+]#[C-].[C-]#[N+]C1=C(/C=C/C=C2/C=C(/C=C/c3cc4sc(N(c5ccc(N(C)C)cc5)c5ccc(N(CC)CCO[Si](c6ccccc6)(c6ccccc6)C(C)(C)C)cc5)cc4s3)CC(C)(C)C2)C(C)(c2ccccc2)O/C1=C(\C)[N+]#[C-].[C-]#[N+]C1=C(/C=C/C=C2\CC(C)(C)CC(/C=C/c3cc4sc(N(c5ccc(N(C)C)cc5)c5ccc(N(CC)CCO[Si](c6ccccc6)(c6ccccc6)C(C)(C)C)cc5)cc4s3)=C2CCCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C(C)(c2ccccc2)O/C1=C(\C)[N+]#[C-].

What is the InChIKey of 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine?

The InChIKey is RPVBPRMBZOOEJX-WMHANULYSA-N. The full InChI is InChI=1S/C87H95N5O3S2Si2.C68H71N5O2S2Si.C63H61N5O2S3Si.C50H49N5OS2/c1-16-91(57-59-94-99(85(6,7)8,75-41-28-20-29-42-75)76-43-30-21-31-44-76)69-50-54-71(55-51-69)92(70-52-48-68(49-53-70)90(14)15)81-61-80-79(97-81)60-72(96-80)56-47-66-63-86(9,10)62-65(34-32-46-78-82(89-13)83(64(2)88-12)95-87(78,11)67-35-22-17-23-36-67)77(66)45-33-58-93-98(84(3,4)5,73-37-24-18-25-38-73)74-39-26-19-27-40-74;1-13-72(42-43-74-78(66(3,4)5,58-27-19-15-20-28-58)59-29-21-16-22-30-59)54-35-39-56(40-36-54)73(55-37-33-53(34-38-55)71(11)12)63-46-62-61(77-63)45-57(76-62)41-32-51-44-50(47-67(6,7)48-51)24-23-31-60-64(70-10)65(49(2)69-9)75-68(60,8)52-25-17-14-18-26-52;1-9-67(39-40-69-74(62(3,4)5,54-21-15-11-16-22-54)55-23-17-12-18-24-55)48-27-31-50(32-28-48)68(49-29-25-47(26-30-49)66(7)8)60-42-59-58(73-60)41-53(72-59)36-35-51-33-34-52(71-51)37-38-57-56(44-65)61(45(2)43-64)70-63(57,6)46-19-13-10-14-20-46;1-34(51-5)48-47(52-6)43(50(4,56-48)37-16-12-11-13-17-37)18-14-15-35-29-36(33-49(2,3)32-35)19-28-42-30-44-45(57-42)31-46(58-44)55(40-24-20-38(21-25-40)53(7)8)41-26-22-39(23-27-41)54(9)10/h17-32,34-44,46-56,60-61H,16,33,45,57-59,62-63H2,1-11,14-15H3;14-41,44-46H,13,42-43,47-48H2,1-8,11-12H3;10-38,41-42H,9,39-40H2,1-8H3;11-31H,32-33H2,1-4,7-10H3/b46-32+,56-47+,65-34+,83-64+;31-23+,41-32+,50-24-,65-49+;36-35+,38-37+,61-45-;18-14+,28-19+,35-15-,48-34+.

What are the key properties of 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine?

4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine has a molecular weight of 4306.23 g/mol, XLogP of 68.34, 68 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-2-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;(2Z)-4-[(E)-2-[5-[(E)-2-[5-[N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-(dimethylamino)anilino]thieno[3,2-b]thiophen-2-yl]ethenyl]thiophen-2-yl]ethenyl]-2-(1-cyanoethylidene)-5-methyl-5-phenylfuran-3-carbonitrile;4-N-[4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine;4-N-[4-(dimethylamino)phenyl]-4-N-[2-[(E)-2-[(3E)-3-[(E)-3-[(5E)-4-isocyano-5-(1-isocyanoethylidene)-2-methyl-2-phenylfuran-3-yl]prop-2-enylidene]-5,5-dimethylcyclohexen-1-yl]ethenyl]thieno[3,2-b]thiophen-5-yl]-1-N,1-N-dimethylbenzene-1,4-diamine is sourced from PubChem (CID 165063716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).