4-cyano-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzenesulfonamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-cyano-benzenesulfonamide CAS Name: 4-cyano-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]benzenesulfonamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-4-cyanobenzenesulfonamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-cyano-benzenesulfonamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N4O2S/c1-15-20(16(2)24(23-15)14-18-6-4-3-5-7-18)13-22-27(25,26)19-10-8-17(12-21)9-11-19/h3-11,22H,13-14H2,1-2H3