4-tert-butyl-N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]benzenesulfonamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-tert-butyl-benzenesulfonamide CAS Name: 4-tert-butyl-N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]benzenesulfonamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-4-tert-butylbenzenesulfonamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-tert-butyl-benzenesulfonamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H27N3O2S/c1-16-21(17(2)25(23-16)15-18-9-7-6-8-10-18)24-28(26,27)20-13-11-19(12-14-20)22(3,4)5/h6-14,24H,15H2,1-5H3