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

Systemtic Name: (2S)-2-(diethylcarbamoylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-(diethylcarbamoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[diethylamino(oxo)methyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-(diethylcarbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(diethylcarbamoylamino)-4-(methylthio)butyrate Formula: C10H19N2O3S- MolecularWeight: 247.33446

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C10H20N2O3S/c1-4-12(5-2)10(15)11-8(9(13)14)6-7-16-3/h8H,4-7H2,1-3H3,(H,11,15)(H,13,14)/p-1/t8-/m0/s1