2-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinazolin-4-amine hydrochloride

Systemtic Name: 2-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinazolin-4-amine hydrochloride Openeye Name: 2-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinazolin-4-amine hydrochloride CAS Name: 2-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinazolinamine hydrochloride IUPAC Name: 2-(4-tert-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinazolin-4-amine hydrochloride Traditional Name: [2-(4-tert-butylphenyl)quinazolin-4-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine hydrochloride Formula: C26H26ClN3O2 MolecularWeight: 447.95654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC5=C(C=C4)OCCO5.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC5=C(C=C4)OCCO5.Cl

InChI

InChI=1S/C26H25N3O2.ClH/c1-26(2,3)18-10-8-17(9-11-18)24-28-21-7-5-4-6-20(21)25(29-24)27-19-12-13-22-23(16-19)31-15-14-30-22;/h4-13,16H,14-15H2,1-3H3,(H,27,28,29);1H