N4-(5-bromanylpyridin-2-yl)-N6-butyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(5-bromanylpyridin-2-yl)-N6-butyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(5-bromo-2-pyridyl)-N6-butyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(5-bromo-2-pyridinyl)-N6-butyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(5-bromopyridin-2-yl)-6-N-butyl-5-nitropyrimidine-4,6-diamine Traditional Name: (5-bromo-2-pyridyl)-[6-(butylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H15BrN6O2 MolecularWeight: 367.2012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=NC=C(C=C2)Br

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=NC=C(C=C2)Br

InChI

InChI=1S/C13H15BrN6O2/c1-2-3-6-15-12-11(20(21)22)13(18-8-17-12)19-10-5-4-9(14)7-16-10/h4-5,7-8H,2-3,6H2,1H3,(H2,15,16,17,18,19)