calcium 2-azanyl-4-methylsulfanyl-2-oxidanidyl-butanoate

Systemtic Name: calcium 2-azanyl-4-methylsulfanyl-2-oxidanidyl-butanoate Openeye Name: calcium 2-amino-4-methylsulfanyl-2-oxido-butanoate CAS Name: calcium 2-amino-4-(methylthio)-2-oxidobutanoate IUPAC Name: calcium 2-amino-4-methylsulfanyl-2-oxidobutanoate Traditional Name: calcium 2-amino-4-(methylthio)-2-oxido-butyrate Formula: C5H9CaNO3S MolecularWeight: 203.27286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H10NO3S.Ca/c1-10-3-2-5(6,9)4(7)8;/h2-3,6H2,1H3,(H,7,8);/q-1;+2/p-1