(2S)-2-(decanoylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-(decanoylamino)-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-(decanoylamino)-4-methylsulfanyl-butanoic acid CAS Name: (2S)-4-(methylthio)-2-(1-oxodecylamino)butanoic acid IUPAC Name: (2S)-2-(decanoylamino)-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-(caprylamino)-4-(methylthio)butyric acid Formula: C15H29NO3S MolecularWeight: 303.46066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)N[C@@H](CCSC)C(=O)O

InChI

InChI=1S/C15H29NO3S/c1-3-4-5-6-7-8-9-10-14(17)16-13(15(18)19)11-12-20-2/h13H,3-12H2,1-2H3,(H,16,17)(H,18,19)/t13-/m0/s1