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

Systemtic Name: (E)-N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-ethoxy-quinazolin-6-yl]-5-piperidin-1-yl-pent-2-enamide Openeye Name: (E)-N-[4-(3-chloro-4-fluoro-anilino)-7-ethoxy-quinazolin-6-yl]-5-(1-piperidyl)pent-2-enamide CAS Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-ethoxy-6-quinazolinyl]-5-(1-piperidinyl)-2-pentenamide IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-ethoxyquinazolin-6-yl]-5-piperidin-1-ylpent-2-enamide Traditional Name: (E)-N-[4-(3-chloro-4-fluoro-anilino)-7-ethoxy-quinazolin-6-yl]-5-piperidino-pent-2-enamide Formula: C26H29ClFN5O2 MolecularWeight: 497.992163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)C=CCCN4CCCCC4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)/C=C/CCN4CCCCC4

InChI

InChI=1S/C26H29ClFN5O2/c1-2-35-24-16-22-19(26(30-17-29-22)31-18-9-10-21(28)20(27)14-18)15-23(24)32-25(34)8-4-7-13-33-11-5-3-6-12-33/h4,8-10,14-17H,2-3,5-7,11-13H2,1H3,(H,32,34)(H,29,30,31)/b8-4+