[4-[4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxypiperidin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxypiperidin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[4-(3-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-1-piperidyl]-(3-pyridyl)methanone CAS Name: [4-[[4-(3-chloro-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]-1-piperidinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[4-(3-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxypiperidin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[4-(3-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxypiperidino]-(3-pyridyl)methanone Formula: C26H23ClFN5O3 MolecularWeight: 507.943923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C(=CC=C3)Cl)F)OC4CCN(CC4)C(=O)C5=CN=CC=C5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C(=CC=C3)Cl)F)OC4CCN(CC4)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C26H23ClFN5O3/c1-35-22-12-18-21(30-15-31-25(18)32-20-6-2-5-19(27)24(20)28)13-23(22)36-17-7-10-33(11-8-17)26(34)16-4-3-9-29-14-16/h2-6,9,12-15,17H,7-8,10-11H2,1H3,(H,30,31,32)