6-(4-azanylcyclohexyl)oxy-N-(3-chloranyl-4-fluoranyl-phenyl)-7-methoxy-quinazolin-2-amine

Systemtic Name: 6-(4-azanylcyclohexyl)oxy-N-(3-chloranyl-4-fluoranyl-phenyl)-7-methoxy-quinazolin-2-amine Openeye Name: 6-(4-aminocyclohexoxy)-N-(3-chloro-4-fluoro-phenyl)-7-methoxy-quinazolin-2-amine CAS Name: 6-(4-aminocyclohexyl)oxy-N-(3-chloro-4-fluorophenyl)-7-methoxy-2-quinazolinamine IUPAC Name: 6-(4-aminocyclohexyl)oxy-N-(3-chloro-4-fluorophenyl)-7-methoxyquinazolin-2-amine Traditional Name: [6-(4-aminocyclohexoxy)-7-methoxy-quinazolin-2-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C21H22ClFN4O2 MolecularWeight: 416.876383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=NC(=NC2=C1)NC3=CC(=C(C=C3)F)Cl)OC4CCC(CC4)N

Isomeric SMILES

COC1=C(C=C2C=NC(=NC2=C1)NC3=CC(=C(C=C3)F)Cl)OC4CCC(CC4)N

InChI

InChI=1S/C21H22ClFN4O2/c1-28-19-10-18-12(8-20(19)29-15-5-2-13(24)3-6-15)11-25-21(27-18)26-14-4-7-17(23)16(22)9-14/h4,7-11,13,15H,2-3,5-6,24H2,1H3,(H,25,26,27)