6,7-diethoxy-N-(3-ethynylphenyl)quinazolin-4-amine hydrochloride

Systemtic Name: 6,7-diethoxy-N-(3-ethynylphenyl)quinazolin-4-amine hydrochloride Openeye Name: 6,7-diethoxy-N-(3-ethynylphenyl)quinazolin-4-amine hydrochloride CAS Name: 6,7-diethoxy-N-(3-ethynylphenyl)-4-quinazolinamine hydrochloride IUPAC Name: 6,7-diethoxy-N-(3-ethynylphenyl)quinazolin-4-amine hydrochloride Traditional Name: (6,7-diethoxyquinazolin-4-yl)-(3-ethynylphenyl)amine hydrochloride Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OCC.Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OCC.Cl

InChI

InChI=1S/C20H19N3O2.ClH/c1-4-14-8-7-9-15(10-14)23-20-16-11-18(24-5-2)19(25-6-3)12-17(16)21-13-22-20;/h1,7-13H,5-6H2,2-3H3,(H,21,22,23);1H