N-[3-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-2-yl]oxypropyl]-N-methyl-methanesulfonamide

Systemtic Name: N-[3-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-2-yl]oxypropyl]-N-methyl-methanesulfonamide Openeye Name: N-[3-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-2-yl]oxypropyl]-N-methyl-methanesulfonamide CAS Name: N-[3-[[4-(4-bromo-2-fluoroanilino)-6-methoxy-2-quinazolinyl]oxy]propyl]-N-methylmethanesulfonamide IUPAC Name: N-[3-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-2-yl]oxypropyl]-N-methylmethanesulfonamide Traditional Name: N-[3-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-2-yl]oxypropyl]-N-methyl-methanesulfonamide Formula: C20H22BrFN4O4S MolecularWeight: 513.380483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=NC2=C(C=C(C=C2)OC)C(=N1)NC3=C(C=C(C=C3)Br)F)S(=O)(=O)C

Isomeric SMILES

CN(CCCOC1=NC2=C(C=C(C=C2)OC)C(=N1)NC3=C(C=C(C=C3)Br)F)S(=O)(=O)C

InChI

InChI=1S/C20H22BrFN4O4S/c1-26(31(3,27)28)9-4-10-30-20-24-17-8-6-14(29-2)12-15(17)19(25-20)23-18-7-5-13(21)11-16(18)22/h5-8,11-12H,4,9-10H2,1-3H3,(H,23,24,25)