(E)-N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]-5-piperidin-1-yl-pent-2-enamide

Systemtic Name: (E)-N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]-5-piperidin-1-yl-pent-2-enamide Openeye Name: (E)-N-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]-5-(1-piperidyl)pent-2-enamide CAS Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]-5-(1-piperidinyl)-2-pentenamide IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-5-piperidin-1-ylpent-2-enamide Traditional Name: (E)-N-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]-5-piperidino-pent-2-enamide Formula: C25H27ClFN5O2 MolecularWeight: 483.965583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)C=CCCN4CCCCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)/C=C/CCN4CCCCC4

InChI

InChI=1S/C25H27ClFN5O2/c1-34-23-15-21-18(25(29-16-28-21)30-17-8-9-20(27)19(26)13-17)14-22(23)31-24(33)7-3-6-12-32-10-4-2-5-11-32/h3,7-9,13-16H,2,4-6,10-12H2,1H3,(H,31,33)(H,28,29,30)/b7-3+