N-(5-azanyl-4-oxidanylidene-1H-pyrimidin-6-yl)-2-(dimethylamino)-4-nitro-benzamide

Systemtic Name: N-(5-azanyl-4-oxidanylidene-1H-pyrimidin-6-yl)-2-(dimethylamino)-4-nitro-benzamide Openeye Name: N-(5-amino-4-oxo-1H-pyrimidin-6-yl)-2-(dimethylamino)-4-nitro-benzamide CAS Name: N-(5-amino-4-oxo-1H-pyrimidin-6-yl)-2-(dimethylamino)-4-nitrobenzamide IUPAC Name: N-(5-amino-4-oxo-1H-pyrimidin-6-yl)-2-(dimethylamino)-4-nitrobenzamide Traditional Name: N-(5-amino-4-keto-1H-pyrimidin-6-yl)-2-(dimethylamino)-4-nitro-benzamide Formula: C13H14N6O4 MolecularWeight: 318.28806

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)NC2=C(C(=O)N=CN2)N

Isomeric SMILES

CN(C)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)NC2=C(C(=O)N=CN2)N

InChI

InChI=1S/C13H14N6O4/c1-18(2)9-5-7(19(22)23)3-4-8(9)12(20)17-11-10(14)13(21)16-6-15-11/h3-6H,14H2,1-2H3,(H2,15,16,17,20,21)