1,3-dimethyl-5,6-bis(methylamino)pyrimidine-2,4-dione hydrate

Systemtic Name: 1,3-dimethyl-5,6-bis(methylamino)pyrimidine-2,4-dione hydrate Openeye Name: 1,3-dimethyl-5,6-bis(methylamino)pyrimidine-2,4-dione hydrate CAS Name: 1,3-dimethyl-5,6-bis(methylamino)pyrimidine-2,4-dione hydrate IUPAC Name: 1,3-dimethyl-5,6-bis(methylamino)pyrimidine-2,4-dione hydrate Traditional Name: 1,3-dimethyl-5,6-bis(methylamino)pyrimidine-2,4-quinone hydrate Formula: C8H16N4O3 MolecularWeight: 216.23764

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(N(C(=O)N(C1=O)C)C)NC.O

Isomeric SMILES

CNC1=C(N(C(=O)N(C1=O)C)C)NC.O

InChI

InChI=1S/C8H14N4O2.H2O/c1-9-5-6(10-2)11(3)8(14)12(4)7(5)13;/h9-10H,1-4H3;1H2