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

Systemtic Name: methyl 4-[(Z)-[3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-(3-isobutyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoate CAS Name: 4-[(Z)-[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-(3-isobutyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid methyl ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CC2=CC=C(C=C2)C(=O)OC)SC1=S

Isomeric SMILES

CC(C)CN1C(=O)/C(=C/C2=CC=C(C=C2)C(=O)OC)/SC1=S

InChI

InChI=1S/C16H17NO3S2/c1-10(2)9-17-14(18)13(22-16(17)21)8-11-4-6-12(7-5-11)15(19)20-3/h4-8,10H,9H2,1-3H3/b13-8-