(2S,5S)-5-tert-butyl-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid

Systemtic Name: (2S,5S)-5-tert-butyl-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid Openeye Name: (2S,5S)-5-tert-butyl-2-(4-cyanophenyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylic acid CAS Name: (2S,5S)-5-tert-butyl-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid IUPAC Name: (2S,5S)-5-tert-butyl-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid Traditional Name: (2S,5S)-5-tert-butyl-2-(4-cyanophenyl)-1-tosyl-3-pyrroline-3-carboxylic acid Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C=C(C2C3=CC=C(C=C3)C#N)C(=O)O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](C=C([C@@H]2C3=CC=C(C=C3)C#N)C(=O)O)C(C)(C)C

InChI

InChI=1S/C23H24N2O4S/c1-15-5-11-18(12-6-15)30(28,29)25-20(23(2,3)4)13-19(22(26)27)21(25)17-9-7-16(14-24)8-10-17/h5-13,20-21H,1-4H3,(H,26,27)/t20-,21-/m0/s1