4-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 4-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 4-[[4-(4-chloro-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 4-[4-(4-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 4-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-1-(4-methylpiperazino)butan-1-one Formula: C24H27ClFN5O3 MolecularWeight: 487.954283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Cl)F)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Cl)F)OC

InChI

InChI=1S/C24H27ClFN5O3/c1-30-7-9-31(10-8-30)23(32)4-3-11-34-22-14-20-17(13-21(22)33-2)24(28-15-27-20)29-19-6-5-16(25)12-18(19)26/h5-6,12-15H,3-4,7-11H2,1-2H3,(H,27,28,29)