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

Systemtic Name: methyl 4-[(Z)-[4-oxidanylidene-3-(4-oxidanylidene-4-piperidin-1-yl-butyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[4-oxo-3-[4-oxo-4-(1-piperidyl)butyl]-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[4-oxo-3-[4-oxo-4-(1-piperidinyl)butyl]-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[4-oxo-3-(4-oxo-4-piperidin-1-ylbutyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[4-keto-3-(4-keto-4-piperidino-butyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid methyl ester Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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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)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)N3CCCCC3

InChI

InChI=1S/C21H24N2O4S2/c1-27-20(26)16-9-7-15(8-10-16)14-17-19(25)23(21(28)29-17)13-5-6-18(24)22-11-3-2-4-12-22/h7-10,14H,2-6,11-13H2,1H3/b17-14-