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

Systemtic Name: [(2S,5R)-2-(4-bromophenyl)-5-ethyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenyl-methanone Openeye Name: [(2S,5R)-2-(4-bromophenyl)-5-ethyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrol-3-yl]-phenyl-methanone CAS Name: [(2S,5R)-2-(4-bromophenyl)-5-ethyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenylmethanone IUPAC Name: [(2S,5R)-2-(4-bromophenyl)-5-ethyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-phenylmethanone Traditional Name: [(2S,5R)-2-(4-bromophenyl)-5-ethyl-1-tosyl-3-pyrrolin-3-yl]-phenyl-methanone Formula: C26H24BrNO3S MolecularWeight: 510.44266

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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)Br)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)Br)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H24BrNO3S/c1-3-22-17-24(26(29)20-7-5-4-6-8-20)25(19-11-13-21(27)14-12-19)28(22)32(30,31)23-15-9-18(2)10-16-23/h4-17,22,25H,3H2,1-2H3/t22-,25+/m1/s1