[(2S,5R)-5-ethyl-2-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenyl-methanone

Systemtic Name: [(2S,5R)-5-ethyl-2-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenyl-methanone Openeye Name: [(2S,5R)-5-ethyl-2-(4-methoxyphenyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrol-3-yl]-phenyl-methanone CAS Name: [(2S,5R)-5-ethyl-2-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenylmethanone IUPAC Name: [(2S,5R)-5-ethyl-2-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenylmethanone Traditional Name: [(2S,5R)-5-ethyl-2-(4-methoxyphenyl)-1-tosyl-3-pyrrolin-3-yl]-phenyl-methanone Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C=C(C(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC[C@@H]1C=C([C@@H](N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27NO4S/c1-4-22-18-25(27(29)21-8-6-5-7-9-21)26(20-12-14-23(32-3)15-13-20)28(22)33(30,31)24-16-10-19(2)11-17-24/h5-18,22,26H,4H2,1-3H3/t22-,26+/m1/s1