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

Systemtic Name: N6-(5-bromanylpyridin-2-yl)-N4-methyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N6-(5-bromo-2-pyridyl)-N4-methyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N6-(5-bromo-2-pyridinyl)-N4-methyl-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 6-N-(5-bromopyridin-2-yl)-4-N-methyl-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: [6-[(5-bromo-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-methyl-phenyl-amine Formula: C16H13BrN6O2 MolecularWeight: 401.21742

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Br

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN6O2/c1-22(12-5-3-2-4-6-12)16-14(23(24)25)15(19-10-20-16)21-13-8-7-11(17)9-18-13/h2-10H,1H3,(H,18,19,20,21)