[2-[(3-chlorophenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 1,5-dimethylpyrazole-4-carboxylate

Systemtic Name: [2-[(3-chlorophenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 1,5-dimethylpyrazole-4-carboxylate Openeye Name: [2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]methyl 1,5-dimethylpyrazole-4-carboxylate CAS Name: 1,5-dimethyl-4-pyrazolecarboxylic acid [2-(N-acetyl-3-chloroanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3-chloroanilino)-1,3-thiazol-4-yl]methyl 1,5-dimethylpyrazole-4-carboxylate Traditional Name: 1,5-dimethylpyrazole-4-carboxylic acid [2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]methyl ester Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)OCC2=CSC(=N2)N(C3=CC(=CC=C3)Cl)C(=O)C

Isomeric SMILES

CC1=C(C=NN1C)C(=O)OCC2=CSC(=N2)N(C3=CC(=CC=C3)Cl)C(=O)C

InChI

InChI=1S/C18H17ClN4O3S/c1-11-16(8-20-22(11)3)17(25)26-9-14-10-27-18(21-14)23(12(2)24)15-6-4-5-13(19)7-15/h4-8,10H,9H2,1-3H3