(3S)-5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)-3,4-dihydropyrazole

Systemtic Name: (3S)-5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)-3,4-dihydropyrazole Openeye Name: (3S)-5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-(p-tolylsulfonyl)-3,4-dihydropyrazole CAS Name: (3S)-5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)-3,4-dihydropyrazole IUPAC Name: (3S)-5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)-3,4-dihydropyrazole Traditional Name: (5S)-3-(4-methoxyphenyl)-5-(4-nitrophenyl)-1-tosyl-2-pyrazoline Formula: C23H21N3O5S MolecularWeight: 451.49494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O5S/c1-16-3-13-21(14-4-16)32(29,30)25-23(18-5-9-19(10-6-18)26(27)28)15-22(24-25)17-7-11-20(31-2)12-8-17/h3-14,23H,15H2,1-2H3/t23-/m0/s1