2-azanyl-4-methylsulfanyl-butanoic acid; 2-azanyl-4-sulfanyl-butanoic acid; 2-azanyl-3-sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-butanoic acid; 2-azanyl-4-sulfanyl-butanoic acid; 2-azanyl-3-sulfanyl-propanoic acid Openeye Name: 2-amino-4-methylsulfanyl-butanoic acid; 2-amino-4-sulfanyl-butanoic acid; 2-amino-3-sulfanyl-propanoic acid CAS Name: 2-amino-4-mercaptobutanoic acid; 2-amino-3-mercaptopropanoic acid; 2-amino-4-(methylthio)butanoic acid IUPAC Name: 2-amino-4-methylsulfanylbutanoic acid; 2-amino-4-sulfanylbutanoic acid; 2-amino-3-sulfanylpropanoic acid Traditional Name: 2-amino-4-mercapto-butyric acid; 2-amino-3-mercapto-propionic acid; 2-amino-4-(methylthio)butyric acid Formula: C12H27N3O6S3 MolecularWeight: 405.55428

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N.C(CS)C(C(=O)O)N.C(C(C(=O)O)N)S

Isomeric SMILES

CSCCC(C(=O)O)N.C(CS)C(C(=O)O)N.C(C(C(=O)O)N)S

InChI

InChI=1S/C5H11NO2S.C4H9NO2S.C3H7NO2S/c1-9-3-2-4(6)5(7)8;5-3(1-2-8)4(6)7;4-2(1-7)3(5)6/h4H,2-3,6H2,1H3,(H,7,8);3,8H,1-2,5H2,(H,6,7);2,7H,1,4H2,(H,5,6)