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

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[(3-methoxyphenyl)methyl]quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-[(3-methoxyphenyl)methyl]quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-[(3-methoxyphenyl)methyl]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-[(3-methoxyphenyl)methyl]quinazoline-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-m-anisyl-amine Formula: C22H18ClFN4O MolecularWeight: 408.855923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClFN4O/c1-29-17-4-2-3-14(9-17)12-25-15-6-8-21-18(10-15)22(27-13-26-21)28-16-5-7-20(24)19(23)11-16/h2-11,13,25H,12H2,1H3,(H,26,27,28)