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

Systemtic Name: (2S,5R)-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-5-pentyl-2,5-dihydropyrrole-3-carboxylic acid Openeye Name: (2S,5R)-2-(4-cyanophenyl)-5-pentyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylic acid CAS Name: (2S,5R)-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-5-pentyl-2,5-dihydropyrrole-3-carboxylic acid IUPAC Name: (2S,5R)-2-(4-cyanophenyl)-1-(4-methylphenyl)sulfonyl-5-pentyl-2,5-dihydropyrrole-3-carboxylic acid Traditional Name: (2S,5R)-5-amyl-2-(4-cyanophenyl)-1-tosyl-3-pyrroline-3-carboxylic acid Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=C(C(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C#N)C(=O)O

Isomeric SMILES

CCCCC[C@@H]1C=C([C@@H](N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C24H26N2O4S/c1-3-4-5-6-20-15-22(24(27)28)23(19-11-9-18(16-25)10-12-19)26(20)31(29,30)21-13-7-17(2)8-14-21/h7-15,20,23H,3-6H2,1-2H3,(H,27,28)/t20-,23+/m1/s1