N4-(3-chloranyl-4-fluoranyl-phenyl)-5-nitro-N6-pyridin-4-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-5-nitro-N6-pyridin-4-yl-pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-5-nitro-N6-(4-pyridyl)pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-5-nitro-N6-pyridin-4-ylpyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-5-nitro-6-N-pyridin-4-ylpyrimidine-4,6-diamine Traditional Name: [6-(3-chloro-4-fluoro-anilino)-5-nitro-pyrimidin-4-yl]-(4-pyridyl)amine Formula: C15H10ClFN6O2 MolecularWeight: 360.730303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C(=NC=N2)NC3=CC=NC=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C(=NC=N2)NC3=CC=NC=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C15H10ClFN6O2/c16-11-7-10(1-2-12(11)17)22-15-13(23(24)25)14(19-8-20-15)21-9-3-5-18-6-4-9/h1-8H,(H2,18,19,20,21,22)