N-[3-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxypropyl]-N-methyl-methanesulfonamide

Systemtic Name: N-[3-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxypropyl]-N-methyl-methanesulfonamide Openeye Name: N-[3-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxypropyl]-N-methyl-methanesulfonamide CAS Name: N-[3-[[4-(4-bromo-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]propyl]-N-methylmethanesulfonamide IUPAC Name: N-[3-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxypropyl]-N-methylmethanesulfonamide Traditional Name: N-[3-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxypropyl]-N-methyl-methanesulfonamide Formula: C20H22BrFN4O4S MolecularWeight: 513.380483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=C(C=C2C(=C1)N=CN=C2NC3=C(C=C(C=C3)Br)F)OC)S(=O)(=O)C

Isomeric SMILES

CN(CCCOC1=C(C=C2C(=C1)N=CN=C2NC3=C(C=C(C=C3)Br)F)OC)S(=O)(=O)C

InChI

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