ethyl 5-(4-bromophenyl)carbonyl-4-methyl-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(4-bromophenyl)carbonyl-4-methyl-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl 2-anilino-5-(4-bromobenzoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-anilino-5-[(4-bromophenyl)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-anilino-5-(4-bromobenzoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-anilino-5-(4-bromobenzoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H18BrNO3S MolecularWeight: 444.34152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C2=CC=C(C=C2)Br)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C2=CC=C(C=C2)Br)NC3=CC=CC=C3

InChI

InChI=1S/C21H18BrNO3S/c1-3-26-21(25)17-13(2)19(18(24)14-9-11-15(22)12-10-14)27-20(17)23-16-7-5-4-6-8-16/h4-12,23H,3H2,1-2H3