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

Systemtic Name: (2S,3R)-5-ethylsulfanyl-4-methyl-2-(methylamino)-3-oxidanyl-pentanal Openeye Name: (2S,3R)-5-ethylsulfanyl-3-hydroxy-4-methyl-2-(methylamino)pentanal CAS Name: (2S,3R)-5-(ethylthio)-3-hydroxy-4-methyl-2-(methylamino)pentanal IUPAC Name: (2S,3R)-5-ethylsulfanyl-3-hydroxy-4-methyl-2-(methylamino)pentanal Traditional Name: (2S,3R)-5-(ethylthio)-3-hydroxy-4-methyl-2-(methylamino)valeraldehyde Formula: C9H19NO2S MolecularWeight: 205.31766

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(C)C(C(C=O)NC)O

Isomeric SMILES

CCSCC(C)[C@H]([C@@H](C=O)NC)O

InChI

InChI=1S/C9H19NO2S/c1-4-13-6-7(2)9(12)8(5-11)10-3/h5,7-10,12H,4,6H2,1-3H3/t7?,8-,9-/m1/s1