methyl 4-[(E)-3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(3-cyano-2-thienyl)amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[(3-cyano-2-thiophenyl)amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(3-cyanothiophen-2-yl)amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[(3-cyano-2-thienyl)amino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C16H12N2O3S/c1-21-16(20)12-5-2-11(3-6-12)4-7-14(19)18-15-13(10-17)8-9-22-15/h2-9H,1H3,(H,18,19)/b7-4+