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

Systemtic Name: methyl 4-[[4-oxidanylidene-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[[4-oxo-3-(3-pyridylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[[4-oxo-3-(3-pyridinylmethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[[4-keto-3-(3-pyridylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid methyl ester Formula: C18H14N2O3S2 MolecularWeight: 370.44536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC3=CN=CC=C3

InChI

InChI=1S/C18H14N2O3S2/c1-23-17(22)14-6-4-12(5-7-14)9-15-16(21)20(18(24)25-15)11-13-3-2-8-19-10-13/h2-10H,11H2,1H3