4-[5-(4-methylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenyl-pyrazole

Systemtic Name: 4-[5-(4-methylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenyl-pyrazole Openeye Name: 4-[2-(benzenesulfonyl)-5-(p-tolyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenyl-pyrazole CAS Name: 4-[2-(benzenesulfonyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole IUPAC Name: 4-[2-(benzenesulfonyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole Traditional Name: 4-[2-besyl-5-(p-tolyl)-2-pyrazolin-3-yl]-1,3-diphenyl-pyrazole Formula: C31H26N4O2S MolecularWeight: 518.62874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H26N4O2S/c1-23-17-19-24(20-18-23)29-21-30(35(32-29)38(36,37)27-15-9-4-10-16-27)28-22-34(26-13-7-3-8-14-26)33-31(28)25-11-5-2-6-12-25/h2-20,22,30H,21H2,1H3