methyl 4-[(Z)-[4-oxidanylidene-3-(6-oxidanylidene-6-pyrrolidin-1-yl-hexyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[4-oxidanylidene-3-(6-oxidanylidene-6-pyrrolidin-1-yl-hexyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[4-oxo-3-(6-oxo-6-pyrrolidin-1-yl-hexyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[4-oxo-3-[6-oxo-6-(1-pyrrolidinyl)hexyl]-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[4-oxo-3-(6-oxo-6-pyrrolidin-1-ylhexyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[4-keto-3-(6-keto-6-pyrrolidino-hexyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid methyl ester Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCCCC(=O)N3CCCC3

InChI

InChI=1S/C22H26N2O4S2/c1-28-21(27)17-10-8-16(9-11-17)15-18-20(26)24(22(29)30-18)14-4-2-3-7-19(25)23-12-5-6-13-23/h8-11,15H,2-7,12-14H2,1H3/b18-15-