N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[(2-chlorophenyl)methylthio]-4-cyano-1H-pyrazol-5-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[(2-chlorobenzyl)thio]-4-cyano-1H-pyrazol-5-yl]-4-methyl-benzenesulfonamide Formula: C18H15ClN4O2S2 MolecularWeight: 418.9203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NN2)SCC3=CC=CC=C3Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NN2)SCC3=CC=CC=C3Cl)C#N

InChI

InChI=1S/C18H15ClN4O2S2/c1-12-6-8-14(9-7-12)27(24,25)23-17-15(10-20)18(22-21-17)26-11-13-4-2-3-5-16(13)19/h2-9H,11H2,1H3,(H2,21,22,23)