N-[7-(2-acetamidoethoxy)-4-[(4-bromanyl-2-fluoranyl-phenyl)amino]quinazolin-6-yl]-N-methyl-prop-2-enamide

Systemtic Name: N-[7-(2-acetamidoethoxy)-4-[(4-bromanyl-2-fluoranyl-phenyl)amino]quinazolin-6-yl]-N-methyl-prop-2-enamide Openeye Name: N-[7-(2-acetamidoethoxy)-4-(4-bromo-2-fluoro-anilino)quinazolin-6-yl]-N-methyl-prop-2-enamide CAS Name: N-[7-(2-acetamidoethoxy)-4-(4-bromo-2-fluoroanilino)-6-quinazolinyl]-N-methyl-2-propenamide IUPAC Name: N-[7-(2-acetamidoethoxy)-4-(4-bromo-2-fluoroanilino)quinazolin-6-yl]-N-methylprop-2-enamide Traditional Name: N-[7-(2-acetamidoethoxy)-4-(4-bromo-2-fluoro-anilino)quinazolin-6-yl]-N-methyl-acrylamide Formula: C22H21BrFN5O3 MolecularWeight: 502.336243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCOC1=C(C=C2C(=C1)N=CN=C2NC3=C(C=C(C=C3)Br)F)N(C)C(=O)C=C

Isomeric SMILES

CC(=O)NCCOC1=C(C=C2C(=C1)N=CN=C2NC3=C(C=C(C=C3)Br)F)N(C)C(=O)C=C

InChI

InChI=1S/C22H21BrFN5O3/c1-4-21(31)29(3)19-10-15-18(11-20(19)32-8-7-25-13(2)30)26-12-27-22(15)28-17-6-5-14(23)9-16(17)24/h4-6,9-12H,1,7-8H2,2-3H3,(H,25,30)(H,26,27,28)