(3S)-3,5-bis(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrazole

Systemtic Name: (3S)-3,5-bis(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrazole Openeye Name: (3S)-3,5-bis(3,4-dimethoxyphenyl)-2-(p-tolylsulfonyl)-1,3-dihydropyrazole CAS Name: (3S)-3,5-bis(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrazole IUPAC Name: (3S)-3,5-bis(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrazole Traditional Name: (5S)-3,5-bis(3,4-dimethoxyphenyl)-1-tosyl-3-pyrazoline Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C=C(N2)C3=CC(=C(C=C3)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O6S/c1-17-6-10-20(11-7-17)35(29,30)28-22(19-9-13-24(32-3)26(15-19)34-5)16-21(27-28)18-8-12-23(31-2)25(14-18)33-4/h6-16,22,27H,1-5H3/t22-/m0/s1