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

Systemtic Name: 1-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-3-thiomorpholin-4-yl-propan-2-ol Openeye Name: 1-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-3-thiomorpholino-propan-2-ol CAS Name: 1-[[4-(4-chloro-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]-3-thiomorpholin-4-yl-2-propanol IUPAC Name: 1-[4-(4-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-3-thiomorpholin-4-ylpropan-2-ol Traditional Name: 1-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-3-thiomorpholino-propan-2-ol Formula: C22H24ClFN4O3S MolecularWeight: 478.967363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC(CN4CCSCC4)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC(CN4CCSCC4)O

InChI

InChI=1S/C22H24ClFN4O3S/c1-30-20-9-16-19(10-21(20)31-12-15(29)11-28-4-6-32-7-5-28)25-13-26-22(16)27-18-3-2-14(23)8-17(18)24/h2-3,8-10,13,15,29H,4-7,11-12H2,1H3,(H,25,26,27)