N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide

Systemtic Name: N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide Openeye Name: N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-4-(1,1-dimethylpropyl)benzenesulfonamide CAS Name: N-[5-(4-chlorophenyl)-2-methyl-3-pyrazolyl]-4-(2-methylbutan-2-yl)benzenesulfonamide IUPAC Name: N-[5-(4-chlorophenyl)-2-methylpyrazol-3-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide Traditional Name: 4-tert-amyl-N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]benzenesulfonamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=NN2C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=NN2C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3O2S/c1-5-21(2,3)16-8-12-18(13-9-16)28(26,27)24-20-14-19(23-25(20)4)15-6-10-17(22)11-7-15/h6-14,24H,5H2,1-4H3