N-[2-[3-(2-methylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide

Systemtic Name: N-[2-[3-(2-methylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide Openeye Name: N-[2-[2-(benzenesulfonyl)-3-(o-tolyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide CAS Name: N-[2-[2-(benzenesulfonyl)-3-(2-methylphenyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide IUPAC Name: N-[2-[2-(benzenesulfonyl)-3-(2-methylphenyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide Traditional Name: N-[2-[1-besyl-5-(o-tolyl)-2-pyrazolin-3-yl]phenyl]benzenesulfonamide Formula: C28H25N3O4S2 MolecularWeight: 531.6458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2CC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H25N3O4S2/c1-21-12-8-9-17-24(21)28-20-27(29-31(28)37(34,35)23-15-6-3-7-16-23)25-18-10-11-19-26(25)30-36(32,33)22-13-4-2-5-14-22/h2-19,28,30H,20H2,1H3