methyl 3-[(2-cyano-3-oxidanylidene-3-phenyl-prop-1-enyl)amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-cyano-3-oxidanylidene-3-phenyl-prop-1-enyl)amino]thiophene-2-carboxylate Openeye Name: methyl 3-[(2-cyano-3-oxo-3-phenyl-prop-1-enyl)amino]thiophene-2-carboxylate CAS Name: 3-[(2-cyano-3-oxo-3-phenylprop-1-enyl)amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-cyano-3-oxo-3-phenylprop-1-enyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(2-cyano-3-keto-3-phenyl-prop-1-enyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C16H12N2O3S MolecularWeight: 312.34308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC=C(C#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC=C(C#N)C(=O)C2=CC=CC=C2

InChI

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