(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-N-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-N-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-N-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-prop-2-enamide CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-N-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-N-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethylprop-2-enamide Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-N-ethyl-N-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]acrylamide Formula: C22H21BrFN3O4 MolecularWeight: 490.322243

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C22H21BrFN3O4/c1-4-27(21(28)8-5-13-9-14(23)6-7-16(13)24)12-20-25-17-11-19(31-3)18(30-2)10-15(17)22(29)26-20/h5-11H,4,12H2,1-3H3,(H,25,26,29)/b8-5+