3-(4-chlorophenyl)-6-(cyanomethyl)-4-methyl-2-(1H-pyrazol-5-yl)benzenesulfonamide

Systemtic Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-methyl-2-(1H-pyrazol-5-yl)benzenesulfonamide Openeye Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-methyl-2-(1H-pyrazol-5-yl)benzenesulfonamide CAS Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-methyl-2-(1H-pyrazol-5-yl)benzenesulfonamide IUPAC Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-methyl-2-(1H-pyrazol-5-yl)benzenesulfonamide Traditional Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-methyl-2-(1H-pyrazol-5-yl)benzenesulfonamide Formula: C18H15ClN4O2S MolecularWeight: 386.8553

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C2=CC=C(C=C2)Cl)C3=CC=NN3)S(=O)(=O)N)CC#N

Isomeric SMILES

CC1=CC(=C(C(=C1C2=CC=C(C=C2)Cl)C3=CC=NN3)S(=O)(=O)N)CC#N

InChI

InChI=1S/C18H15ClN4O2S/c1-11-10-13(6-8-20)18(26(21,24)25)17(15-7-9-22-23-15)16(11)12-2-4-14(19)5-3-12/h2-5,7,9-10H,6H2,1H3,(H,22,23)(H2,21,24,25)