[1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 2-(4-chlorophenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(4-chlorophenyl)-4-methyl-5-thiazolecarboxylic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] 2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-chlorophenyl)-4-methyl-thiazole-5-carboxylic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C20H16ClN3O5S MolecularWeight: 445.87614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C(=O)OC(C)C(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C(=O)OC(C)C(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H16ClN3O5S/c1-11-17(30-19(22-11)13-7-9-14(21)10-8-13)20(26)29-12(2)18(25)23-15-5-3-4-6-16(15)24(27)28/h3-10,12H,1-2H3,(H,23,25)