5-bromanyl-N2-(3-chloranyl-4-fluoranyl-phenyl)-N4-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine hydrochloride

Systemtic Name: 5-bromanyl-N2-(3-chloranyl-4-fluoranyl-phenyl)-N4-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine hydrochloride Openeye Name: 5-bromo-N2-(3-chloro-4-fluoro-phenyl)-N4-[2-(4-pyridyl)ethyl]pyrimidine-2,4-diamine hydrochloride CAS Name: 5-bromo-N2-(3-chloro-4-fluorophenyl)-N4-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine hydrochloride IUPAC Name: 5-bromo-2-N-(3-chloro-4-fluorophenyl)-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine hydrochloride Traditional Name: [5-bromo-2-(3-chloro-4-fluoro-anilino)pyrimidin-4-yl]-[2-(4-pyridyl)ethyl]amine hydrochloride Formula: C17H15BrCl2FN5 MolecularWeight: 459.142903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC=C(C(=N2)NCCC3=CC=NC=C3)Br)Cl)F.Cl

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC=C(C(=N2)NCCC3=CC=NC=C3)Br)Cl)F.Cl

InChI

InChI=1S/C17H14BrClFN5.ClH/c18-13-10-23-17(24-12-1-2-15(20)14(19)9-12)25-16(13)22-8-5-11-3-6-21-7-4-11;/h1-4,6-7,9-10H,5,8H2,(H2,22,23,24,25);1H