N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[(2,4-dimethoxyphenyl)methyl]quinazoline-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[(2,4-dimethoxyphenyl)methyl]quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-[(2,4-dimethoxyphenyl)methyl]quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-[(2,4-dimethoxyphenyl)methyl]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-[(2,4-dimethoxyphenyl)methyl]quinazoline-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-(2,4-dimethoxybenzyl)amine Formula: C23H20ClFN4O2 MolecularWeight: 438.881903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)OC

InChI

InChI=1S/C23H20ClFN4O2/c1-30-17-6-3-14(22(11-17)31-2)12-26-15-5-8-21-18(9-15)23(28-13-27-21)29-16-4-7-20(25)19(24)10-16/h3-11,13,26H,12H2,1-2H3,(H,27,28,29)