N-(4-cyano-3-methylsulfanyl-1H-pyrazol-5-yl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(4-cyano-3-methylsulfanyl-1H-pyrazol-5-yl)-4-methyl-benzenesulfonamide Openeye Name: N-(4-cyano-3-methylsulfanyl-1H-pyrazol-5-yl)-4-methyl-benzenesulfonamide CAS Name: N-[4-cyano-3-(methylthio)-1H-pyrazol-5-yl]-4-methylbenzenesulfonamide IUPAC Name: N-(4-cyano-3-methylsulfanyl-1H-pyrazol-5-yl)-4-methylbenzenesulfonamide Traditional Name: N-[4-cyano-3-(methylthio)-1H-pyrazol-5-yl]-4-methyl-benzenesulfonamide Formula: C12H12N4O2S2 MolecularWeight: 308.37928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NN2)SC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NN2)SC)C#N

InChI

InChI=1S/C12H12N4O2S2/c1-8-3-5-9(6-4-8)20(17,18)16-11-10(7-13)12(19-2)15-14-11/h3-6H,1-2H3,(H2,14,15,16)