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

Systemtic Name: 4-[5-(4-methoxyphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenyl-pyrazole Openeye Name: 4-[2-(benzenesulfonyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenyl-pyrazole CAS Name: 4-[2-(benzenesulfonyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole IUPAC Name: 4-[2-(benzenesulfonyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole Traditional Name: 4-[2-besyl-5-(4-methoxyphenyl)-2-pyrazolin-3-yl]-1,3-diphenyl-pyrazole Formula: C31H26N4O3S MolecularWeight: 534.62814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=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

COC1=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/C31H26N4O3S/c1-38-26-19-17-23(18-20-26)29-21-30(35(32-29)39(36,37)27-15-9-4-10-16-27)28-22-34(25-13-7-3-8-14-25)33-31(28)24-11-5-2-6-12-24/h2-20,22,30H,21H2,1H3