(E)-N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-propan-2-yloxy-quinazolin-6-yl]-4-piperidin-1-yl-but-2-enamide

Systemtic Name: (E)-N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-propan-2-yloxy-quinazolin-6-yl]-4-piperidin-1-yl-but-2-enamide Openeye Name: (E)-N-[4-(3-chloro-4-fluoro-anilino)-7-isopropoxy-quinazolin-6-yl]-4-(1-piperidyl)but-2-enamide CAS Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-propan-2-yloxy-6-quinazolinyl]-4-(1-piperidinyl)-2-butenamide IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-propan-2-yloxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide Traditional Name: (E)-N-[4-(3-chloro-4-fluoro-anilino)-7-isopropoxy-quinazolin-6-yl]-4-piperidino-but-2-enamide Formula: C26H29ClFN5O2 MolecularWeight: 497.992163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)C=CCN4CCCCC4

Isomeric SMILES

CC(C)OC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)/C=C/CN4CCCCC4

InChI

InChI=1S/C26H29ClFN5O2/c1-17(2)35-24-15-22-19(26(30-16-29-22)31-18-8-9-21(28)20(27)13-18)14-23(24)32-25(34)7-6-12-33-10-4-3-5-11-33/h6-9,13-17H,3-5,10-12H2,1-2H3,(H,32,34)(H,29,30,31)/b7-6+