tert-butyl (2S)-4-methyl-2-[[(2R,3S)-2-methylsulfanyl-3-oxidanyl-hexyl]amino]pentanoate

Systemtic Name: tert-butyl (2S)-4-methyl-2-[[(2R,3S)-2-methylsulfanyl-3-oxidanyl-hexyl]amino]pentanoate Openeye Name: tert-butyl (2S)-2-[[(2R,3S)-3-hydroxy-2-methylsulfanyl-hexyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2R,3S)-3-hydroxy-2-(methylthio)hexyl]amino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2R,3S)-3-hydroxy-2-methylsulfanylhexyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2R,3S)-3-hydroxy-2-(methylthio)hexyl]amino]-4-methyl-valeric acid tert-butyl ester Formula: C17H35NO3S MolecularWeight: 333.5297

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CNC(CC(C)C)C(=O)OC(C)(C)C)SC)O

Isomeric SMILES

CCC[C@@H]([C@@H](CN[C@@H](CC(C)C)C(=O)OC(C)(C)C)SC)O

InChI

InChI=1S/C17H35NO3S/c1-8-9-14(19)15(22-7)11-18-13(10-12(2)3)16(20)21-17(4,5)6/h12-15,18-19H,8-11H2,1-7H3/t13-,14-,15+/m0/s1