4-methylsulfanyl-2-[(2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-(2-oxo-1,3-dihydroimidazol-4-yl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]butanoic acid Traditional Name: 2-[(2-keto-4-imidazoline-4-carbonyl)amino]-4-(methylthio)butyric acid Formula: C9H13N3O4S MolecularWeight: 259.28222

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CNC(=O)N1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CNC(=O)N1

InChI

InChI=1S/C9H13N3O4S/c1-17-3-2-5(8(14)15)11-7(13)6-4-10-9(16)12-6/h4-5H,2-3H2,1H3,(H,11,13)(H,14,15)(H2,10,12,16)