N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-2-pyridin-3-yl-quinazolin-4-amine

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-2-pyridin-3-yl-quinazolin-4-amine Openeye Name: N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-2-(3-pyridyl)quinazolin-4-amine CAS Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-(3-pyridinyl)-4-quinazolinamine IUPAC Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-pyridin-3-ylquinazolin-4-amine Traditional Name: [4-(difluoromethoxy)-3-methoxy-benzyl]-[2-(3-pyridyl)quinazolin-4-yl]amine Formula: C22H18F2N4O2 MolecularWeight: 408.400726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)OC(F)F

InChI

InChI=1S/C22H18F2N4O2/c1-29-19-11-14(8-9-18(19)30-22(23)24)12-26-21-16-6-2-3-7-17(16)27-20(28-21)15-5-4-10-25-13-15/h2-11,13,22H,12H2,1H3,(H,26,27,28)