4-methyl-N-[(1R,2S)-2-[2-(4-methylphenyl)sulfonylphenyl]-2-methylsulfanyl-1-phenyl-ethyl]benzenesulfinamide

Systemtic Name: 4-methyl-N-[(1R,2S)-2-[2-(4-methylphenyl)sulfonylphenyl]-2-methylsulfanyl-1-phenyl-ethyl]benzenesulfinamide Openeye Name: 4-methyl-N-[(1R,2S)-2-methylsulfanyl-1-phenyl-2-[2-(p-tolylsulfonyl)phenyl]ethyl]benzenesulfinamide CAS Name: 4-methyl-N-[(1R,2S)-2-[2-(4-methylphenyl)sulfonylphenyl]-2-(methylthio)-1-phenylethyl]benzenesulfinamide IUPAC Name: 4-methyl-N-[(1R,2S)-2-[2-(4-methylphenyl)sulfonylphenyl]-2-methylsulfanyl-1-phenylethyl]benzenesulfinamide Traditional Name: 4-methyl-N-[(1R,2S)-2-(methylthio)-1-phenyl-2-(2-tosylphenyl)ethyl]benzenesulfinamide Formula: C29H29NO3S3 MolecularWeight: 535.74046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(C2=CC=CC=C2)C(C3=CC=CC=C3S(=O)(=O)C4=CC=C(C=C4)C)SC

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)N[C@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3S(=O)(=O)C4=CC=C(C=C4)C)SC

InChI

InChI=1S/C29H29NO3S3/c1-21-13-17-24(18-14-21)35(31)30-28(23-9-5-4-6-10-23)29(34-3)26-11-7-8-12-27(26)36(32,33)25-19-15-22(2)16-20-25/h4-20,28-30H,1-3H3/t28-,29+,35+/m1/s1