ethyl 4-[[(2Z)-2-(1-cyano-2-oxidanylidene-propylidene)-4-oxidanylidene-1,3-thiazolidin-5-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[(2Z)-2-(1-cyano-2-oxidanylidene-propylidene)-4-oxidanylidene-1,3-thiazolidin-5-yl]methyl]benzoate Openeye Name: ethyl 4-[[(2Z)-2-(1-cyano-2-oxo-propylidene)-4-oxo-thiazolidin-5-yl]methyl]benzoate CAS Name: 4-[[(2Z)-2-(1-cyano-2-oxopropylidene)-4-oxo-5-thiazolidinyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2Z)-2-(1-cyano-2-oxopropylidene)-4-oxo-1,3-thiazolidin-5-yl]methyl]benzoate Traditional Name: 4-[[(2Z)-2-(1-cyano-2-keto-propylidene)-4-keto-thiazolidin-5-yl]methyl]benzoic acid ethyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CC2C(=O)NC(=C(C#N)C(=O)C)S2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CC2C(=O)N/C(=C(\C#N)/C(=O)C)/S2

InChI

InChI=1S/C17H16N2O4S/c1-3-23-17(22)12-6-4-11(5-7-12)8-14-15(21)19-16(24-14)13(9-18)10(2)20/h4-7,14H,3,8H2,1-2H3,(H,19,21)/b16-13-