6-(butan-2-ylamino)-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-(butan-2-ylamino)-5-nitro-1H-pyrimidin-4-one Openeye Name: 5-nitro-6-(sec-butylamino)-1H-pyrimidin-4-one CAS Name: 6-(butan-2-ylamino)-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(butan-2-ylamino)-5-nitro-1H-pyrimidin-4-one Traditional Name: 5-nitro-6-(sec-butylamino)-1H-pyrimidin-4-one Formula: C8H12N4O3 MolecularWeight: 212.20588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=O)N=CN1)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C(=O)N=CN1)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O3/c1-3-5(2)11-7-6(12(14)15)8(13)10-4-9-7/h4-5H,3H2,1-2H3,(H2,9,10,11,13)