(2-acetamido-1,3-thiazol-4-yl)methyl 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C17H14ClFN4O3S MolecularWeight: 408.834463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC2=CSC(=N2)NC(=O)C)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC2=CSC(=N2)NC(=O)C)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H14ClFN4O3S/c1-9-14(15(18)23(22-9)13-5-3-11(19)4-6-13)16(25)26-7-12-8-27-17(21-12)20-10(2)24/h3-6,8H,7H2,1-2H3,(H,20,21,24)