ethyl 2-(2-cyanoethanoylamino)-4-(4-fluorophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-cyanoethanoylamino)-4-(4-fluorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-cyanoacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate CAS Name: 2-[(2-cyano-1-oxoethyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-cyanoacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-cyanoacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C16H13FN2O3S MolecularWeight: 332.349423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CC#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CC#N

InChI

InChI=1S/C16H13FN2O3S/c1-2-22-16(21)14-12(10-3-5-11(17)6-4-10)9-23-15(14)19-13(20)7-8-18/h3-6,9H,2,7H2,1H3,(H,19,20)