1-[[5-oxidanyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]amino]thiourea hydrate

Systemtic Name: 1-[[5-oxidanyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]amino]thiourea hydrate Openeye Name: [(5-hydroxy-2,4,6-trioxo-hexahydropyrimidin-5-yl)amino]thiourea hydrate CAS Name: [(5-hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)amino]thiourea hydrate IUPAC Name: [(5-hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)amino]thiourea hydrate Traditional Name: [(5-hydroxy-2,4,6-triketo-hexahydropyrimidin-5-yl)amino]thiourea hydrate Formula: C5H9N5O5S MolecularWeight: 251.22046

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Descriptors Computed from Structure

Canonical SMILES:

C1(=O)C(C(=O)NC(=O)N1)(NNC(=S)N)O.O

Isomeric SMILES

C1(=O)C(C(=O)NC(=O)N1)(NNC(=S)N)O.O

InChI

InChI=1S/C5H7N5O4S.H2O/c6-3(15)9-10-5(14)1(11)7-4(13)8-2(5)12;/h10,14H,(H3,6,9,15)(H2,7,8,11,12,13);1H2