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

Systemtic Name: N-(4-methylsulfinyl-1-oxidanyl-butyl)-2-(phenylmethyl)-3-sulfanyl-propanamide Openeye Name: 2-benzyl-N-(1-hydroxy-4-methylsulfinyl-butyl)-3-sulfanyl-propanamide CAS Name: N-(1-hydroxy-4-methylsulfinylbutyl)-2-(mercaptomethyl)-3-phenylpropanamide IUPAC Name: 2-benzyl-N-(1-hydroxy-4-methylsulfinylbutyl)-3-sulfanylpropanamide Traditional Name: 2-benzyl-N-(1-hydroxy-4-methylsulfinyl-butyl)-3-mercapto-propionamide Formula: C15H23NO3S2 MolecularWeight: 329.47802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO3S2/c1-21(19)9-5-8-14(17)16-15(18)13(11-20)10-12-6-3-2-4-7-12/h2-4,6-7,13-14,17,20H,5,8-11H2,1H3,(H,16,18)