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

Systemtic Name: [(2S,5R)-5-ethyl-1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrol-3-yl]-(4-methylphenyl)methanone Openeye Name: [(2S,5R)-5-ethyl-2-phenyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrol-3-yl]-(p-tolyl)methanone CAS Name: [(2S,5R)-5-ethyl-1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrol-3-yl]-(4-methylphenyl)methanone IUPAC Name: [(2S,5R)-5-ethyl-1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrol-3-yl]-(4-methylphenyl)methanone Traditional Name: [(2S,5R)-5-ethyl-2-phenyl-1-tosyl-3-pyrrolin-3-yl]-(p-tolyl)methanone Formula: C27H27NO3S MolecularWeight: 445.57318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27NO3S/c1-4-23-18-25(27(29)22-14-10-19(2)11-15-22)26(21-8-6-5-7-9-21)28(23)32(30,31)24-16-12-20(3)13-17-24/h5-18,23,26H,4H2,1-3H3/t23-,26+/m1/s1