N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(2-pyridin-4-ylethoxy)quinazolin-4-amine hydrochloride

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(2-pyridin-4-ylethoxy)quinazolin-4-amine hydrochloride Openeye Name: N-(4-chloro-2-fluoro-phenyl)-6-methoxy-7-[2-(4-pyridyl)ethoxy]quinazolin-4-amine hydrochloride CAS Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(2-pyridin-4-ylethoxy)-4-quinazolinamine hydrochloride IUPAC Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(2-pyridin-4-ylethoxy)quinazolin-4-amine hydrochloride Traditional Name: (4-chloro-2-fluoro-phenyl)-[6-methoxy-7-[2-(4-pyridyl)ethoxy]quinazolin-4-yl]amine hydrochloride Formula: C22H19Cl2FN4O2 MolecularWeight: 461.316263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCCC4=CC=NC=C4.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCCC4=CC=NC=C4.Cl

InChI

InChI=1S/C22H18ClFN4O2.ClH/c1-29-20-11-16-19(12-21(20)30-9-6-14-4-7-25-8-5-14)26-13-27-22(16)28-18-3-2-15(23)10-17(18)24;/h2-5,7-8,10-13H,6,9H2,1H3,(H,26,27,28);1H