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

Systemtic Name: N4-(5-chloranylpyridin-2-yl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(5-chloro-2-pyridyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(5-chloro-2-pyridinyl)-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(5-chloropyridin-2-yl)-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (5-chloro-2-pyridyl)-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H15ClN6O3 MolecularWeight: 338.7496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN6O3/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)