N4-(5-bromanylpyridin-2-yl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(5-bromanylpyridin-2-yl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(5-bromo-2-pyridyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(5-bromo-2-pyridinyl)-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(5-bromopyridin-2-yl)-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (5-bromo-2-pyridyl)-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H15BrN6O3 MolecularWeight: 383.2006

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=NC=C(C=C2)Br

Isomeric SMILES

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=NC=C(C=C2)Br

InChI

InChI=1S/C13H15BrN6O3/c1-23-6-2-5-15-12-11(20(21)22)13(18-8-17-12)19-10-4-3-9(14)7-16-10/h3-4,7-8H,2,5-6H2,1H3,(H2,15,16,17,18,19)