(2S)-N-(4-methylsulfinyl-1-oxidanyl-butyl)-2-(phenylmethyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: (2S)-N-(4-methylsulfinyl-1-oxidanyl-butyl)-2-(phenylmethyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: (2S)-2-benzyl-3-benzylsulfanyl-N-(1-hydroxy-4-methylsulfinyl-butyl)propanamide CAS Name: (2S)-N-(1-hydroxy-4-methylsulfinylbutyl)-2-(phenylmethyl)-3-(phenylmethylthio)propanamide IUPAC Name: (2S)-2-benzyl-3-benzylsulfanyl-N-(1-hydroxy-4-methylsulfinylbutyl)propanamide Traditional Name: (2S)-2-benzyl-3-(benzylthio)-N-(1-hydroxy-4-methylsulfinyl-butyl)propionamide Formula: C22H29NO3S2 MolecularWeight: 419.60056

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CCCC(NC(=O)C(CC1=CC=CC=C1)CSCC2=CC=CC=C2)O

Isomeric SMILES

CS(=O)CCCC(NC(=O)[C@H](CC1=CC=CC=C1)CSCC2=CC=CC=C2)O

InChI

InChI=1S/C22H29NO3S2/c1-28(26)14-8-13-21(24)23-22(25)20(15-18-9-4-2-5-10-18)17-27-16-19-11-6-3-7-12-19/h2-7,9-12,20-21,24H,8,13-17H2,1H3,(H,23,25)/t20-,21?,28?/m1/s1