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

Systemtic Name: N4-(5-bromanylpyridin-2-yl)-5-nitro-N6-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-(5-bromo-2-pyridyl)-5-nitro-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: N4-(5-bromo-2-pyridinyl)-5-nitro-N6-(2-oxolanylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(5-bromopyridin-2-yl)-5-nitro-6-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine Traditional Name: (5-bromo-2-pyridyl)-[5-nitro-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]amine Formula: C14H15BrN6O3 MolecularWeight: 395.2113

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Br

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Br

InChI

InChI=1S/C14H15BrN6O3/c15-9-3-4-11(16-6-9)20-14-12(21(22)23)13(18-8-19-14)17-7-10-2-1-5-24-10/h3-4,6,8,10H,1-2,5,7H2,(H2,16,17,18,19,20)