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

Systemtic Name: N4-butyl-N6-(5-chloranylpyridin-2-yl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N6-(5-chloro-2-pyridyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-(5-chloro-2-pyridinyl)-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-6-N-(5-chloropyridin-2-yl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-[6-[(5-chloro-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C14H17ClN6O2 MolecularWeight: 336.77678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C14H17ClN6O2/c1-3-4-7-20(2)14-12(21(22)23)13(17-9-18-14)19-11-6-5-10(15)8-16-11/h5-6,8-9H,3-4,7H2,1-2H3,(H,16,17,18,19)