2-azanyl-6-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 2-azanyl-6-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]-5-nitro-1H-pyrimidin-4-one Openeye Name: 2-amino-6-[(1,1-dimethyl-2-oxo-propyl)amino]-5-nitro-1H-pyrimidin-4-one CAS Name: 2-amino-6-[(2-methyl-3-oxobutan-2-yl)amino]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 2-amino-6-[(2-methyl-3-oxobutan-2-yl)amino]-5-nitro-1H-pyrimidin-4-one Traditional Name: 2-amino-6-[(2-keto-1,1-dimethyl-propyl)amino]-5-nitro-1H-pyrimidin-4-one Formula: C9H13N5O4 MolecularWeight: 255.23062

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)NC1=C(C(=O)N=C(N1)N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(C)(C)NC1=C(C(=O)N=C(N1)N)[N+](=O)[O-]

InChI

InChI=1S/C9H13N5O4/c1-4(15)9(2,3)13-6-5(14(17)18)7(16)12-8(10)11-6/h1-3H3,(H4,10,11,12,13,16)