1-(azepan-1-yl)-3-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-propan-2-ol CAS Name: 1-(1-azepanyl)-3-[[4-(4-chloro-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[4-(4-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxypropan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-propan-2-ol Formula: C24H28ClFN4O3 MolecularWeight: 474.955523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC(CN4CCCCCC4)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC(CN4CCCCCC4)O

InChI

InChI=1S/C24H28ClFN4O3/c1-32-22-11-18-21(27-15-28-24(18)29-20-7-6-16(25)10-19(20)26)12-23(22)33-14-17(31)13-30-8-4-2-3-5-9-30/h6-7,10-12,15,17,31H,2-5,8-9,13-14H2,1H3,(H,27,28,29)