methyl 3-(2-cyanoethanoylamino)-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-(2-cyanoethanoylamino)-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[(2-cyanoacetyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[(2-cyano-1-oxoethyl)amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-cyanoacetyl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(2-cyanoacetyl)amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C15H12N2O3S MolecularWeight: 300.33238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CC#N

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CC#N

InChI

InChI=1S/C15H12N2O3S/c1-20-15(19)14-11(17-13(18)7-8-16)9-12(21-14)10-5-3-2-4-6-10/h2-6,9H,7H2,1H3,(H,17,18)