[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)amino]-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-(2-chloroanilino)thiazole-4-carboxylate CAS Name: 2-(2-chloroanilino)-4-thiazolecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-(2-chloroanilino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(2-chloroanilino)thiazole-4-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C18H12BrClN2O3S MolecularWeight: 451.72148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NC(=CS2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NC(=CS2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C18H12BrClN2O3S/c19-12-7-5-11(6-8-12)16(23)9-25-17(24)15-10-26-18(22-15)21-14-4-2-1-3-13(14)20/h1-8,10H,9H2,(H,21,22)