methyl 5-[(3-aminophenyl)carbamoyl]-4-methyl-2-(2-phenylethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-[(3-aminophenyl)carbamoyl]-4-methyl-2-(2-phenylethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-[(3-aminophenyl)carbamoyl]-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate CAS Name: 5-[(3-aminoanilino)-oxomethyl]-4-methyl-2-[(1-oxo-2-phenylethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-aminophenyl)carbamoyl]-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-[(3-aminophenyl)carbamoyl]-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)N

InChI

InChI=1S/C22H21N3O4S/c1-13-18(22(28)29-2)21(25-17(26)11-14-7-4-3-5-8-14)30-19(13)20(27)24-16-10-6-9-15(23)12-16/h3-10,12H,11,23H2,1-2H3,(H,24,27)(H,25,26)