S-[[5-(4-chlorophenyl)-3-methylsulfanyl-1H-pyrazol-4-yl]] N,N-dimethylcarbamothioate

Systemtic Name: S-[[5-(4-chlorophenyl)-3-methylsulfanyl-1H-pyrazol-4-yl]] N,N-dimethylcarbamothioate Openeye Name: S-[[5-(4-chlorophenyl)-3-methylsulfanyl-1H-pyrazol-4-yl]] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[[5-(4-chlorophenyl)-3-(methylthio)-1H-pyrazol-4-yl]] ester IUPAC Name: S-[[5-(4-chlorophenyl)-3-methylsulfanyl-1H-pyrazol-4-yl]] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[[5-(4-chlorophenyl)-3-(methylthio)-1H-pyrazol-4-yl]] ester Formula: C13H14ClN3OS2 MolecularWeight: 327.85276

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=C(NN=C1SC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(C)C(=O)SC1=C(NN=C1SC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H14ClN3OS2/c1-17(2)13(18)20-11-10(15-16-12(11)19-3)8-4-6-9(14)7-5-8/h4-7H,1-3H3,(H,15,16)