calcium 2-azanyl-4-methylsulfanyl-butanoate

Systemtic Name: calcium 2-azanyl-4-methylsulfanyl-butanoate Openeye Name: calcium 2-amino-4-methylsulfanyl-butanoate CAS Name: calcium 2-amino-4-(methylthio)butanoate IUPAC Name: calcium 2-amino-4-methylsulfanylbutanoate Traditional Name: calcium 2-amino-4-(methylthio)butyrate Formula: C10H20CaN2O4S2 MolecularWeight: 336.4848

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])N.CSCCC(C(=O)[O-])N.[Ca+2]

Isomeric SMILES

CSCCC(C(=O)[O-])N.CSCCC(C(=O)[O-])N.[Ca+2]

InChI

InChI=1S/2C5H11NO2S.Ca/c2*1-9-3-2-4(6)5(7)8;/h2*4H,2-3,6H2,1H3,(H,7,8);/q;;+2/p-2