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

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[(4-propoxyphenyl)methyl]quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-[(4-propoxyphenyl)methyl]quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-[(4-propoxyphenyl)methyl]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-[(4-propoxyphenyl)methyl]quinazoline-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-(4-propoxybenzyl)amine Formula: C24H22ClFN4O MolecularWeight: 436.909083

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C24H22ClFN4O/c1-2-11-31-19-7-3-16(4-8-19)14-27-17-6-10-23-20(12-17)24(29-15-28-23)30-18-5-9-22(26)21(25)13-18/h3-10,12-13,15,27H,2,11,14H2,1H3,(H,28,29,30)