ethyl 2-[(4-bromophenyl)carbonylamino]-5-[(3-chlorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-bromophenyl)carbonylamino]-5-[(3-chlorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-bromobenzoyl)amino]-5-[(3-chlorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]-5-[(3-chloroanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromobenzoyl)amino]-5-[(3-chlorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(4-bromobenzoyl)amino]-5-[(3-chlorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H18BrClN2O4S MolecularWeight: 521.81132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrClN2O4S/c1-3-30-22(29)17-12(2)18(20(28)25-16-6-4-5-15(24)11-16)31-21(17)26-19(27)13-7-9-14(23)10-8-13/h4-11H,3H2,1-2H3,(H,25,28)(H,26,27)