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

Systemtic Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Openeye Name: 4-(benzyloxymethyl)-3-(4-chlorophenyl)-6-(cyanomethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide CAS Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide IUPAC Name: 3-(4-chlorophenyl)-6-(cyanomethyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Traditional Name: 4-(benzoxymethyl)-3-(4-chlorophenyl)-6-(cyanomethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Formula: C25H21ClN4O3S MolecularWeight: 492.97724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=CC(=C(C(=C2C3=CC=C(C=C3)Cl)C4=CC=NN4)S(=O)(=O)N)CC#N

Isomeric SMILES

C1=CC=C(C=C1)COCC2=CC(=C(C(=C2C3=CC=C(C=C3)Cl)C4=CC=NN4)S(=O)(=O)N)CC#N

InChI

InChI=1S/C25H21ClN4O3S/c26-21-8-6-18(7-9-21)23-20(16-33-15-17-4-2-1-3-5-17)14-19(10-12-27)25(34(28,31)32)24(23)22-11-13-29-30-22/h1-9,11,13-14H,10,15-16H2,(H,29,30)(H2,28,31,32)