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

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-pyridin-4-yl-pyrimidine-4,5,6-triamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-(4-pyridyl)pyrimidine-4,5,6-triamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-pyridin-4-ylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-pyridin-4-ylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3-chloro-4-fluoro-anilino)pyrimidin-4-yl]-(4-pyridyl)amine Formula: C15H12ClFN6 MolecularWeight: 330.747383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C(=NC=N2)NC3=CC=NC=C3)N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C(=NC=N2)NC3=CC=NC=C3)N)Cl)F

InChI

InChI=1S/C15H12ClFN6/c16-11-7-10(1-2-12(11)17)23-15-13(18)14(20-8-21-15)22-9-3-5-19-6-4-9/h1-8H,18H2,(H2,19,20,21,22,23)