6-azanyl-5-bromanyl-1-methyl-pyrimidine-2,4-dione hydrate

Systemtic Name: 6-azanyl-5-bromanyl-1-methyl-pyrimidine-2,4-dione hydrate Openeye Name: 6-amino-5-bromo-1-methyl-pyrimidine-2,4-dione hydrate CAS Name: 6-amino-5-bromo-1-methylpyrimidine-2,4-dione hydrate IUPAC Name: 6-amino-5-bromo-1-methylpyrimidine-2,4-dione hydrate Traditional Name: 6-amino-5-bromo-1-methyl-pyrimidine-2,4-quinone hydrate Formula: C5H8BrN3O3 MolecularWeight: 238.03932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)NC1=O)Br)N.O

Isomeric SMILES

CN1C(=C(C(=O)NC1=O)Br)N.O

InChI

InChI=1S/C5H6BrN3O2.H2O/c1-9-3(7)2(6)4(10)8-5(9)11;/h7H2,1H3,(H,8,10,11);1H2