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

Systemtic Name: ethyl (2S,5R)-5-methyl-1-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5R)-5-methyl-1-(p-tolylsulfonyl)-2-(3-pyridyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5R)-5-methyl-1-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5R)-5-methyl-1-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5R)-5-methyl-2-(3-pyridyl)-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S/c1-4-26-20(23)18-12-15(3)22(19(18)16-6-5-11-21-13-16)27(24,25)17-9-7-14(2)8-10-17/h5-13,15,19H,4H2,1-3H3/t15-,19+/m1/s1