N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-4-(2-methylpropyl)benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-4-(2-methylpropyl)benzenesulfonamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]-4-isobutyl-benzenesulfonamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-4-(2-methylpropyl)benzenesulfonamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-4-(2-methylpropyl)benzenesulfonamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]-4-isobutyl-benzenesulfonamide Formula: C21H24BrN3O2S MolecularWeight: 462.40316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)NS(=O)(=O)C3=CC=C(C=C3)CC(C)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)NS(=O)(=O)C3=CC=C(C=C3)CC(C)C)Br

InChI

InChI=1S/C21H24BrN3O2S/c1-15(2)12-17-8-10-19(11-9-17)28(26,27)24-21-20(22)14-25(23-21)13-18-6-4-16(3)5-7-18/h4-11,14-15H,12-13H2,1-3H3,(H,23,24)