6-(cyanomethyl)-3-(4-methylphenyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide

Systemtic Name: 6-(cyanomethyl)-3-(4-methylphenyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Openeye Name: 4-(benzyloxymethyl)-6-(cyanomethyl)-3-(p-tolyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide CAS Name: 6-(cyanomethyl)-3-(4-methylphenyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide IUPAC Name: 6-(cyanomethyl)-3-(4-methylphenyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Traditional Name: 4-(benzoxymethyl)-6-(cyanomethyl)-3-(p-tolyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C(C=C2COCC3=CC=CC=C3)CC#N)S(=O)(=O)N)C4=CC=NN4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C(C=C2COCC3=CC=CC=C3)CC#N)S(=O)(=O)N)C4=CC=NN4

InChI

InChI=1S/C26H24N4O3S/c1-18-7-9-20(10-8-18)24-22(17-33-16-19-5-3-2-4-6-19)15-21(11-13-27)26(34(28,31)32)25(24)23-12-14-29-30-23/h2-10,12,14-15H,11,16-17H2,1H3,(H,29,30)(H2,28,31,32)