[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: [2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl] 2-(4-chlorophenyl)thiazole-4-carboxylate CAS Name: 2-(4-chlorophenyl)-4-thiazolecarboxylic acid [2-(2-methyl-6-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-6-nitroanilino)-2-oxoethyl] 2-(4-chlorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-chlorophenyl)thiazole-4-carboxylic acid [2-keto-2-(2-methyl-6-nitro-anilino)ethyl] ester Formula: C19H14ClN3O5S MolecularWeight: 431.84956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H14ClN3O5S/c1-11-3-2-4-15(23(26)27)17(11)22-16(24)9-28-19(25)14-10-29-18(21-14)12-5-7-13(20)8-6-12/h2-8,10H,9H2,1H3,(H,22,24)