N-[(1S,2S)-1,2-diphenyl-2-[(phenylmethyl)amino]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1S,2S)-1,2-diphenyl-2-[(phenylmethyl)amino]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,2S)-2-(benzylamino)-1,2-diphenyl-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1S,2S)-1,2-diphenyl-2-[(phenylmethyl)amino]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1S,2S)-2-(benzylamino)-1,2-diphenylethyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,2S)-2-(benzylamino)-1,2-diphenyl-ethyl]-4-methyl-benzenesulfonamide Formula: C28H28N2O2S MolecularWeight: 456.59912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(C3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O2S/c1-22-17-19-26(20-18-22)33(31,32)30-28(25-15-9-4-10-16-25)27(24-13-7-3-8-14-24)29-21-23-11-5-2-6-12-23/h2-20,27-30H,21H2,1H3/t27-,28-/m0/s1