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

Systemtic Name: methyl 2-[(4-fluorophenyl)carbonylamino]-4-methyl-5-[(phenylmethyl)carbamoyl]thiophene-3-carboxylate Openeye Name: methyl 5-(benzylcarbamoyl)-2-[(4-fluorobenzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]-4-methyl-5-[oxo-[(phenylmethyl)amino]methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(benzylcarbamoyl)-2-[(4-fluorobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(benzylcarbamoyl)-2-[(4-fluorobenzoyl)amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H19FN2O4S MolecularWeight: 426.460663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H19FN2O4S/c1-13-17(22(28)29-2)21(25-19(26)15-8-10-16(23)11-9-15)30-18(13)20(27)24-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,24,27)(H,25,26)