ethyl (2S,5R)-1-(4-methylphenyl)sulfonyl-5-propan-2-yl-2-(4-propan-2-ylphenyl)-2,5-dihydropyrrole-3-carboxylate

Systemtic Name: ethyl (2S,5R)-1-(4-methylphenyl)sulfonyl-5-propan-2-yl-2-(4-propan-2-ylphenyl)-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5R)-5-isopropyl-2-(4-isopropylphenyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5R)-1-(4-methylphenyl)sulfonyl-5-propan-2-yl-2-(4-propan-2-ylphenyl)-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5R)-1-(4-methylphenyl)sulfonyl-5-propan-2-yl-2-(4-propan-2-ylphenyl)-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5R)-5-isopropyl-2-p-cumenyl-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C26H33NO4S MolecularWeight: 455.60952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(N(C1C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=C(C=C3)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=C[C@H](N([C@H]1C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=C(C=C3)C)C(C)C

InChI

InChI=1S/C26H33NO4S/c1-7-31-26(28)23-16-24(18(4)5)27(32(29,30)22-14-8-19(6)9-15-22)25(23)21-12-10-20(11-13-21)17(2)3/h8-18,24-25H,7H2,1-6H3/t24-,25-/m0/s1