(2S)-2-(cyclohexylmethylcarbamoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-(cyclohexylmethylcarbamoylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-(cyclohexylmethylcarbamoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(cyclohexylmethylamino)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-(cyclohexylmethylcarbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(cyclohexylmethylcarbamoylamino)-4-(methylthio)butyrate Formula: C13H23N2O3S- MolecularWeight: 287.39832

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)NCC1CCCCC1

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)NCC1CCCCC1

InChI

InChI=1S/C13H24N2O3S/c1-19-8-7-11(12(16)17)15-13(18)14-9-10-5-3-2-4-6-10/h10-11H,2-9H2,1H3,(H,16,17)(H2,14,15,18)/p-1/t11-/m0/s1