N-[(2S)-2-(3-chlorophenyl)-4-(3-phenylpropylamino)butyl]-N-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-2-(3-chlorophenyl)-4-(3-phenylpropylamino)butyl]-N-methyl-benzenesulfonamide Openeye Name: N-[(2S)-2-(3-chlorophenyl)-4-(3-phenylpropylamino)butyl]-N-methyl-benzenesulfonamide CAS Name: N-[(2S)-2-(3-chlorophenyl)-4-(3-phenylpropylamino)butyl]-N-methylbenzenesulfonamide IUPAC Name: N-[(2S)-2-(3-chlorophenyl)-4-(3-phenylpropylamino)butyl]-N-methylbenzenesulfonamide Traditional Name: N-[(2S)-2-(3-chlorophenyl)-4-(3-phenylpropylamino)butyl]-N-methyl-benzenesulfonamide Formula: C26H31ClN2O2S MolecularWeight: 471.05454

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCNCCCC1=CC=CC=C1)C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C[C@@H](CCNCCCC1=CC=CC=C1)C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H31ClN2O2S/c1-29(32(30,31)26-15-6-3-7-16-26)21-24(23-13-8-14-25(27)20-23)17-19-28-18-9-12-22-10-4-2-5-11-22/h2-8,10-11,13-16,20,24,28H,9,12,17-19,21H2,1H3/t24-/m1/s1