N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]-6-morpholin-4-yl-hex-2-ynamide

Systemtic Name: N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]-6-morpholin-4-yl-hex-2-ynamide Openeye Name: N-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-6-morpholino-hex-2-ynamide CAS Name: N-[4-(3-chloro-4-fluoroanilino)-6-quinazolinyl]-6-(4-morpholinyl)-2-hexynamide IUPAC Name: N-[4-(3-chloro-4-fluoroanilino)quinazolin-6-yl]-6-morpholin-4-ylhex-2-ynamide Traditional Name: N-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-6-morpholino-hex-2-ynamide Formula: C24H23ClFN5O2 MolecularWeight: 467.923123

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCC#CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1COCCN1CCCC#CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C24H23ClFN5O2/c25-20-15-18(5-7-21(20)26)30-24-19-14-17(6-8-22(19)27-16-28-24)29-23(32)4-2-1-3-9-31-10-12-33-13-11-31/h5-8,14-16H,1,3,9-13H2,(H,29,32)(H,27,28,30)