N-(3-chloranyl-4-fluoranyl-phenyl)-6-[(3S)-oxolan-3-yl]oxy-7-phenylmethoxy-quinazolin-4-amine hydrochloride

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-[(3S)-oxolan-3-yl]oxy-7-phenylmethoxy-quinazolin-4-amine hydrochloride Openeye Name: 7-benzyloxy-N-(3-chloro-4-fluoro-phenyl)-6-[(3S)-tetrahydrofuran-3-yl]oxy-quinazolin-4-amine hydrochloride CAS Name: N-(3-chloro-4-fluorophenyl)-6-[[(3S)-3-oxolanyl]oxy]-7-phenylmethoxy-4-quinazolinamine hydrochloride IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-[(3S)-oxolan-3-yl]oxy-7-phenylmethoxyquinazolin-4-amine hydrochloride Traditional Name: [7-benzoxy-6-[(3S)-tetrahydrofuran-3-yl]oxy-quinazolin-4-yl]-(3-chloro-4-fluoro-phenyl)amine hydrochloride Formula: C25H22Cl2FN3O3 MolecularWeight: 502.364883

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCC5=CC=CC=C5.Cl

Isomeric SMILES

C1COC[C@H]1OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCC5=CC=CC=C5.Cl

InChI

InChI=1S/C25H21ClFN3O3.ClH/c26-20-10-17(6-7-21(20)27)30-25-19-11-24(33-18-8-9-31-14-18)23(12-22(19)28-15-29-25)32-13-16-4-2-1-3-5-16;/h1-7,10-12,15,18H,8-9,13-14H2,(H,28,29,30);1H/t18-;/m0./s1