2-(4-chlorophenyl)sulfanylethyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OCCSC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

COC1=CN(N=C1C(=O)OCCSC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H17ClN2O3S/c1-24-17-13-22(15-5-3-2-4-6-15)21-18(17)19(23)25-11-12-26-16-9-7-14(20)8-10-16/h2-10,13H,11-12H2,1H3