methyl 4-[(Z)-[4-oxidanylidene-3-(4-oxidanylidene-4-phenylazanyl-butyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[4-oxidanylidene-3-(4-oxidanylidene-4-phenylazanyl-butyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[3-(4-anilino-4-oxo-butyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[3-(4-anilino-4-oxobutyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[3-(4-anilino-4-oxobutyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[3-(4-anilino-4-keto-butyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid methyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H20N2O4S2/c1-28-21(27)16-11-9-15(10-12-16)14-18-20(26)24(22(29)30-18)13-5-8-19(25)23-17-6-3-2-4-7-17/h2-4,6-7,9-12,14H,5,8,13H2,1H3,(H,23,25)/b18-14-