(2S)-2-(hexanoylamino)-4-sulfanyl-butanoic acid

Systemtic Name: (2S)-2-(hexanoylamino)-4-sulfanyl-butanoic acid Openeye Name: (2S)-2-(hexanoylamino)-4-sulfanyl-butanoic acid CAS Name: (2S)-4-mercapto-2-(1-oxohexylamino)butanoic acid IUPAC Name: (2S)-2-(hexanoylamino)-4-sulfanylbutanoic acid Traditional Name: (2S)-2-(caproylamino)-4-mercapto-butyric acid Formula: C10H19NO3S MolecularWeight: 233.32776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CCS)C(=O)O

Isomeric SMILES

CCCCCC(=O)N[C@@H](CCS)C(=O)O

InChI

InChI=1S/C10H19NO3S/c1-2-3-4-5-9(12)11-8(6-7-15)10(13)14/h8,15H,2-7H2,1H3,(H,11,12)(H,13,14)/t8-/m0/s1