(2S)-2-azanyl-N-ethyl-4-methylsulfanyl-butanamide trihydrate hydrochloride

Systemtic Name: (2S)-2-azanyl-N-ethyl-4-methylsulfanyl-butanamide trihydrate hydrochloride Openeye Name: (2S)-2-amino-N-ethyl-4-methylsulfanyl-butanamide trihydrate hydrochloride CAS Name: (2S)-2-amino-N-ethyl-4-(methylthio)butanamide trihydrate hydrochloride IUPAC Name: (2S)-2-amino-N-ethyl-4-methylsulfanylbutanamide trihydrate hydrochloride Traditional Name: (2S)-2-amino-N-ethyl-4-(methylthio)butyramide trihydrate hydrochloride Formula: C7H23ClN2O4S MolecularWeight: 266.78652

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(CCSC)N.O.O.O.Cl

Isomeric SMILES

CCNC(=O)[C@H](CCSC)N.O.O.O.Cl

InChI

InChI=1S/C7H16N2OS.ClH.3H2O/c1-3-9-7(10)6(8)4-5-11-2;;;;/h6H,3-5,8H2,1-2H3,(H,9,10);1H;3*1H2/t6-;;;;/m0..../s1