4-[4-(4-chlorophenyl)-1-(cyanomethyl)-5-(phenylmethoxymethyl)pyrazol-3-yl]benzenesulfonamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C(=NN2CC#N)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C(=NN2CC#N)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

InChI

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