N4-(3-chloranyl-4-fluoranyl-phenyl)-7-(cyclohexylmethoxy)quinazoline-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-7-(cyclohexylmethoxy)quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-7-(cyclohexylmethoxy)quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-7-(cyclohexylmethoxy)quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-7-(cyclohexylmethoxy)quinazoline-4,6-diamine Traditional Name: [6-amino-7-(cyclohexylmethoxy)quinazolin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C21H22ClFN4O MolecularWeight: 400.876983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)N

Isomeric SMILES

C1CCC(CC1)COC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)N

InChI

InChI=1S/C21H22ClFN4O/c22-16-8-14(6-7-17(16)23)27-21-15-9-18(24)20(10-19(15)25-12-26-21)28-11-13-4-2-1-3-5-13/h6-10,12-13H,1-5,11,24H2,(H,25,26,27)