11-[(5E)-5-[1-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

Systemtic Name: 11-[(5E)-5-[1-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Openeye Name: 11-[(5E)-5-[1-[2-(4-methoxyanilino)-2-oxo-ethyl]-2-oxo-indolin-3-ylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]undecanoic acid CAS Name: 11-[(5E)-5-[1-[2-(4-methoxyanilino)-2-oxoethyl]-2-oxo-3-indolylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]undecanoic acid IUPAC Name: 11-[(5E)-5-[1-[2-(4-methoxyanilino)-2-oxoethyl]-2-oxoindol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Traditional Name: 11-[(5E)-4-keto-5-[2-keto-1-[2-keto-2-(p-anisidino)ethyl]indolin-3-ylidene]-2-thioxo-thiazolidin-3-yl]undecanoic acid Formula: C31H35N3O6S2 MolecularWeight: 609.7561

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CCCCCCCCCCC(=O)O)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3/C(=C\4/C(=O)N(C(=S)S4)CCCCCCCCCCC(=O)O)/C2=O

InChI

InChI=1S/C31H35N3O6S2/c1-40-22-17-15-21(16-18-22)32-25(35)20-34-24-13-10-9-12-23(24)27(29(34)38)28-30(39)33(31(41)42-28)19-11-7-5-3-2-4-6-8-14-26(36)37/h9-10,12-13,15-18H,2-8,11,14,19-20H2,1H3,(H,32,35)(H,36,37)/b28-27+