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

Systemtic Name: N4-(5-bromanylpyridin-2-yl)-5-nitro-N6-pyridin-3-yl-pyrimidine-4,6-diamine Openeye Name: N4-(5-bromo-2-pyridyl)-5-nitro-N6-(3-pyridyl)pyrimidine-4,6-diamine CAS Name: N4-(5-bromo-2-pyridinyl)-5-nitro-N6-(3-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(5-bromopyridin-2-yl)-5-nitro-6-N-pyridin-3-ylpyrimidine-4,6-diamine Traditional Name: (5-bromo-2-pyridyl)-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]amine Formula: C14H10BrN7O2 MolecularWeight: 388.1789

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC2=C(C(=NC=N2)NC3=NC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)NC2=C(C(=NC=N2)NC3=NC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H10BrN7O2/c15-9-3-4-11(17-6-9)21-14-12(22(23)24)13(18-8-19-14)20-10-2-1-5-16-7-10/h1-8H,(H2,17,18,19,20,21)