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

Systemtic Name: [(2S,5R)-5-ethyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenyl-methanone Openeye Name: [(2S,5R)-5-ethyl-2-(p-tolyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrol-3-yl]-phenyl-methanone CAS Name: [(2S,5R)-5-ethyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenylmethanone IUPAC Name: [(2S,5R)-5-ethyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenylmethanone Traditional Name: [(2S,5R)-5-ethyl-2-(p-tolyl)-1-tosyl-3-pyrrolin-3-yl]-phenyl-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=C(C=C3)C)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)C)C(=O)C4=CC=CC=C4

InChI

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