N-(3-chloranyl-4-fluoranyl-phenyl)-6-(3-morpholin-4-ylprop-1-ynyl)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-(3-morpholin-4-ylprop-1-ynyl)quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-(3-morpholinoprop-1-ynyl)quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-[3-(4-morpholinyl)prop-1-ynyl]-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-(3-morpholin-4-ylprop-1-ynyl)quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[6-(3-morpholinoprop-1-ynyl)quinazolin-4-yl]amine Formula: C21H18ClFN4O MolecularWeight: 396.845223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1COCCN1CC#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H18ClFN4O/c22-18-13-16(4-5-19(18)23)26-21-17-12-15(3-6-20(17)24-14-25-21)2-1-7-27-8-10-28-11-9-27/h3-6,12-14H,7-11H2,(H,24,25,26)