methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate CAS Name: 5-[(4-fluoroanilino)-oxomethyl]-4-methyl-2-(1-oxopropylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate Traditional Name: 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-propionamido-thiophene-3-carboxylic acid methyl ester Formula: C17H17FN2O4S MolecularWeight: 364.391283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=C(C=C2)F)C)C(=O)OC

Isomeric SMILES

CCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=C(C=C2)F)C)C(=O)OC

InChI

InChI=1S/C17H17FN2O4S/c1-4-12(21)20-16-13(17(23)24-3)9(2)14(25-16)15(22)19-11-7-5-10(18)6-8-11/h5-8H,4H2,1-3H3,(H,19,22)(H,20,21)