2-[(2-chlorophenyl)methylsulfanyl]-N-[(2S)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2-methyl-propanamide

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-[(2S)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2-methyl-propanamide Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-[(1S)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-2-methyl-propanamide CAS Name: 2-[(2-chlorophenyl)methylthio]-N-[(2S)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-methylpropanamide IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-[(2S)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-methylpropanamide Traditional Name: 2-[(2-chlorobenzyl)thio]-N-[(1S)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-2-methyl-propionamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)CO)SCC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)CO)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-22(2,28-14-15-7-3-5-9-19(15)23)21(27)25-17(13-26)11-16-12-24-20-10-6-4-8-18(16)20/h3-10,12,17,24,26H,11,13-14H2,1-2H3,(H,25,27)/t17-/m0/s1