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

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-7-(oxolan-3-ylmethoxy)quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-7-(tetrahydrofuran-3-ylmethoxy)quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-7-(3-oxolanylmethoxy)quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-7-(oxolan-3-ylmethoxy)quinazoline-4,6-diamine Traditional Name: [6-amino-7-(tetrahydrofuran-3-ylmethoxy)quinazolin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C19H18ClFN4O2 MolecularWeight: 388.823223

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1COC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)N

Isomeric SMILES

C1COCC1COC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)N

InChI

InChI=1S/C19H18ClFN4O2/c20-14-5-12(1-2-15(14)21)25-19-13-6-16(22)18(7-17(13)23-10-24-19)27-9-11-3-4-26-8-11/h1-2,5-7,10-11H,3-4,8-9,22H2,(H,23,24,25)