N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-(1,1-dimethylpropyl)benzenesulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-pyrazolyl]-4-(2-methylbutan-2-yl)benzenesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide Traditional Name: 4-tert-amyl-N-[1-(3-cyanobenzyl)pyrazol-4-yl]benzenesulfonamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H24N4O2S/c1-4-22(2,3)19-8-10-21(11-9-19)29(27,28)25-20-14-24-26(16-20)15-18-7-5-6-17(12-18)13-23/h5-12,14,16,25H,4,15H2,1-3H3