(2S,3R)-4-methyl-2-(methylamino)-3-oxidanyl-5-phenylsulfanyl-pentanal

Systemtic Name: (2S,3R)-4-methyl-2-(methylamino)-3-oxidanyl-5-phenylsulfanyl-pentanal Openeye Name: (2S,3R)-3-hydroxy-4-methyl-2-(methylamino)-5-phenylsulfanyl-pentanal CAS Name: (2S,3R)-3-hydroxy-4-methyl-2-(methylamino)-5-(phenylthio)pentanal IUPAC Name: (2S,3R)-3-hydroxy-4-methyl-2-(methylamino)-5-phenylsulfanylpentanal Traditional Name: (2S,3R)-3-hydroxy-4-methyl-2-(methylamino)-5-(phenylthio)valeraldehyde Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)C(C(C=O)NC)O

Isomeric SMILES

CC(CSC1=CC=CC=C1)[C@H]([C@@H](C=O)NC)O

InChI

InChI=1S/C13H19NO2S/c1-10(13(16)12(8-15)14-2)9-17-11-6-4-3-5-7-11/h3-8,10,12-14,16H,9H2,1-2H3/t10?,12-,13-/m1/s1