4-methyl-N-[(1R,2S)-1-phenyl-2-(phenylsulfonyl)but-3-enyl]benzenesulfinamide

Systemtic Name: 4-methyl-N-[(1R,2S)-1-phenyl-2-(phenylsulfonyl)but-3-enyl]benzenesulfinamide Openeye Name: N-[(1R,2S)-2-(benzenesulfonyl)-1-phenyl-but-3-enyl]-4-methyl-benzenesulfinamide CAS Name: N-[(1R,2S)-2-(benzenesulfonyl)-1-phenylbut-3-enyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(1R,2S)-2-(benzenesulfonyl)-1-phenylbut-3-enyl]-4-methylbenzenesulfinamide Traditional Name: N-[(1R,2S)-2-besyl-1-phenyl-but-3-enyl]-4-methyl-benzenesulfinamide Formula: C23H23NO3S2 MolecularWeight: 425.56362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(C2=CC=CC=C2)C(C=C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)N[C@H](C2=CC=CC=C2)[C@H](C=C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H23NO3S2/c1-3-22(29(26,27)21-12-8-5-9-13-21)23(19-10-6-4-7-11-19)24-28(25)20-16-14-18(2)15-17-20/h3-17,22-24H,1H2,2H3/t22-,23+,28-/m0/s1