methyl 4-(4-bromophenyl)-2-[(3-methylphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-2-[(3-methylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(3-methylphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-(m-toluoylamino)thiophene-3-carboxylic acid methyl ester Formula: C20H16BrNO3S MolecularWeight: 430.31494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C20H16BrNO3S/c1-12-4-3-5-14(10-12)18(23)22-19-17(20(24)25-2)16(11-26-19)13-6-8-15(21)9-7-13/h3-11H,1-2H3,(H,22,23)