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

Systemtic Name: N6-(5-chloranylpyridin-2-yl)-N4-ethyl-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(5-chloro-2-pyridyl)-N4-ethyl-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(5-chloro-2-pyridinyl)-N4-ethyl-N4-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(5-chloropyridin-2-yl)-4-N-ethyl-4-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-[(5-chloro-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-ethyl-(m-tolyl)amine Formula: C18H17ClN6O2 MolecularWeight: 384.81958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN6O2/c1-3-24(14-6-4-5-12(2)9-14)18-16(25(26)27)17(21-11-22-18)23-15-8-7-13(19)10-20-15/h4-11H,3H2,1-2H3,(H,20,21,22,23)