N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-(2,5-dimethylbenzyl)amine Formula: C23H20ClFN4 MolecularWeight: 406.883103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C23H20ClFN4/c1-14-3-4-15(2)16(9-14)12-26-17-6-8-22-19(10-17)23(28-13-27-22)29-18-5-7-21(25)20(24)11-18/h3-11,13,26H,12H2,1-2H3,(H,27,28,29)