2-azanyl-4-methylsulfanyl-butanoic acid; 1-[2,5-bis(oxidanylidene)imidazolidin-4-yl]urea

Systemtic Name: 2-azanyl-4-methylsulfanyl-butanoic acid; 1-[2,5-bis(oxidanylidene)imidazolidin-4-yl]urea Openeye Name: 2-amino-4-methylsulfanyl-butanoic acid; (2,5-dioxoimidazolidin-4-yl)urea CAS Name: 2-amino-4-(methylthio)butanoic acid; (2,5-dioxo-4-imidazolidinyl)urea IUPAC Name: 2-amino-4-methylsulfanylbutanoic acid; (2,5-dioxoimidazolidin-4-yl)urea Traditional Name: allantoin; 2-amino-4-(methylthio)butyric acid Formula: C9H17N5O5S MolecularWeight: 307.32678

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N.C1(C(=O)NC(=O)N1)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)O)N.C1(C(=O)NC(=O)N1)NC(=O)N

InChI

InChI=1S/C5H11NO2S.C4H6N4O3/c1-9-3-2-4(6)5(7)8;5-3(10)6-1-2(9)8-4(11)7-1/h4H,2-3,6H2,1H3,(H,7,8);1H,(H3,5,6,10)(H2,7,8,9,11)