4-tert-butyl-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[1-(2-chlorobenzyl)pyrazol-4-yl]benzenesulfonamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-20(2,3)16-8-10-18(11-9-16)27(25,26)23-17-12-22-24(14-17)13-15-6-4-5-7-19(15)21/h4-12,14,23H,13H2,1-3H3