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

Systemtic Name: (3S)-3,5-bis(3,4-dimethoxyphenyl)-2-(phenylsulfonyl)-1,3-dihydropyrazole Openeye Name: (3S)-2-(benzenesulfonyl)-3,5-bis(3,4-dimethoxyphenyl)-1,3-dihydropyrazole CAS Name: (3S)-2-(benzenesulfonyl)-3,5-bis(3,4-dimethoxyphenyl)-1,3-dihydropyrazole IUPAC Name: (3S)-2-(benzenesulfonyl)-3,5-bis(3,4-dimethoxyphenyl)-1,3-dihydropyrazole Traditional Name: (5S)-1-besyl-3,5-bis(3,4-dimethoxyphenyl)-3-pyrazoline Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C=C(NN2S(=O)(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2C=C(NN2S(=O)(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C25H26N2O6S/c1-30-22-12-10-17(14-24(22)32-3)20-16-21(18-11-13-23(31-2)25(15-18)33-4)27(26-20)34(28,29)19-8-6-5-7-9-19/h5-16,21,26H,1-4H3/t21-/m0/s1