N4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N6-ethyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N6-ethyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N6-ethyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N6-ethyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-N-ethyl-5-nitropyrimidine-4,6-diamine Traditional Name: [3-chloro-5-(trifluoromethyl)-2-pyridyl]-[6-(ethylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C12H10ClF3N6O2 MolecularWeight: 362.69501

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C12H10ClF3N6O2/c1-2-17-10-8(22(23)24)11(20-5-19-10)21-9-7(13)3-6(4-18-9)12(14,15)16/h3-5H,2H2,1H3,(H2,17,18,19,20,21)