methyl 2-[(4-fluorophenyl)carbonylamino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-fluorophenyl)carbonylamino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(4-fluorobenzoyl)amino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]-4-methyl-5-[oxo-(1-phenylethylamino)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-fluorobenzoyl)amino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[(4-fluorobenzoyl)amino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C23H21FN2O4S MolecularWeight: 440.487243

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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)NC(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H21FN2O4S/c1-13-18(23(29)30-3)22(26-20(27)16-9-11-17(24)12-10-16)31-19(13)21(28)25-14(2)15-7-5-4-6-8-15/h4-12,14H,1-3H3,(H,25,28)(H,26,27)