S-[3-(4-chlorophenyl)-1-ethanoyl-5-methylsulfanyl-pyrazol-4-yl] ethanethioate

Systemtic Name: S-[3-(4-chlorophenyl)-1-ethanoyl-5-methylsulfanyl-pyrazol-4-yl] ethanethioate Openeye Name: S-[1-acetyl-3-(4-chlorophenyl)-5-methylsulfanyl-pyrazol-4-yl] ethanethioate CAS Name: ethanethioic acid S-[1-acetyl-3-(4-chlorophenyl)-5-(methylthio)-4-pyrazolyl] ester IUPAC Name: S-[1-acetyl-3-(4-chlorophenyl)-5-methylsulfanylpyrazol-4-yl] ethanethioate Traditional Name: ethanethioic acid S-[1-acetyl-3-(4-chlorophenyl)-5-(methylthio)pyrazol-4-yl] ester Formula: C14H13ClN2O2S2 MolecularWeight: 340.84822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=C(C(=N1)C2=CC=C(C=C2)Cl)SC(=O)C)SC

Isomeric SMILES

CC(=O)N1C(=C(C(=N1)C2=CC=C(C=C2)Cl)SC(=O)C)SC

InChI

InChI=1S/C14H13ClN2O2S2/c1-8(18)17-14(20-3)13(21-9(2)19)12(16-17)10-4-6-11(15)7-5-10/h4-7H,1-3H3