[4-[methyl-(4-methylphenyl)carbonyl-amino]phenyl] 5-bromanylthiophene-2-carboxylate

Systemtic Name: [4-[methyl-(4-methylphenyl)carbonyl-amino]phenyl] 5-bromanylthiophene-2-carboxylate Openeye Name: [4-[methyl-(4-methylbenzoyl)amino]phenyl] 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [4-[methyl-[(4-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[methyl-(4-methylbenzoyl)amino]phenyl] 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [4-[methyl(p-toluoyl)amino]phenyl] ester Formula: C20H16BrNO3S MolecularWeight: 430.31494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CC=C(S3)Br

InChI

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