4-[(3R)-3-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]-3-(4-methylphenyl)-1-phenyl-pyrazole

Systemtic Name: 4-[(3R)-3-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]-3-(4-methylphenyl)-1-phenyl-pyrazole Openeye Name: 4-[(3R)-3-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]-1-phenyl-3-(p-tolyl)pyrazole CAS Name: 4-[(3R)-3-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]-3-(4-methylphenyl)-1-phenylpyrazole IUPAC Name: 4-[(3R)-3-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]-3-(4-methylphenyl)-1-phenylpyrazole Traditional Name: 4-[(5R)-1-mesyl-5-(4-methoxyphenyl)-2-pyrazolin-3-yl]-1-phenyl-3-(p-tolyl)pyrazole Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C3=NN(C(C3)C4=CC=C(C=C4)OC)S(=O)(=O)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C3=NN([C@H](C3)C4=CC=C(C=C4)OC)S(=O)(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3S/c1-19-9-11-21(12-10-19)27-24(18-30(29-27)22-7-5-4-6-8-22)25-17-26(31(28-25)35(3,32)33)20-13-15-23(34-2)16-14-20/h4-16,18,26H,17H2,1-3H3/t26-/m1/s1