4-[(2S)-butan-2-yl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[(2S)-butan-2-yl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]benzenesulfonamide Openeye Name: 4-[(1S)-1-methylpropyl]-N-[1-(o-tolylmethyl)pyrazol-4-yl]benzenesulfonamide CAS Name: 4-[(2S)-butan-2-yl]-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[(2S)-butan-2-yl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]benzenesulfonamide Traditional Name: N-[1-(2-methylbenzyl)pyrazol-4-yl]-4-[(1S)-1-methylpropyl]benzenesulfonamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC=C3C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC=C3C

InChI

InChI=1S/C21H25N3O2S/c1-4-16(2)18-9-11-21(12-10-18)27(25,26)23-20-13-22-24(15-20)14-19-8-6-5-7-17(19)3/h5-13,15-16,23H,4,14H2,1-3H3/t16-/m0/s1