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

Systemtic Name: (2S)-2-(hexylcarbamoylamino)-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-(hexylcarbamoylamino)-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[(hexylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-(hexylcarbamoylamino)-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-(hexylcarbamoylamino)-4-(methylthio)butyric acid Formula: C12H24N2O3S MolecularWeight: 276.39556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H24N2O3S/c1-3-4-5-6-8-13-12(17)14-10(11(15)16)7-9-18-2/h10H,3-9H2,1-2H3,(H,15,16)(H2,13,14,17)/t10-/m0/s1