N-(3-ethynylphenyl)-6-(2-imidazol-1-ylethoxy)-7-(2-methoxyethoxy)quinazolin-4-amine dihydrochloride

Systemtic Name: N-(3-ethynylphenyl)-6-(2-imidazol-1-ylethoxy)-7-(2-methoxyethoxy)quinazolin-4-amine dihydrochloride Openeye Name: N-(3-ethynylphenyl)-6-(2-imidazol-1-ylethoxy)-7-(2-methoxyethoxy)quinazolin-4-amine dihydrochloride CAS Name: N-(3-ethynylphenyl)-6-[2-(1-imidazolyl)ethoxy]-7-(2-methoxyethoxy)-4-quinazolinamine dihydrochloride IUPAC Name: N-(3-ethynylphenyl)-6-(2-imidazol-1-ylethoxy)-7-(2-methoxyethoxy)quinazolin-4-amine dihydrochloride Traditional Name: (3-ethynylphenyl)-[6-(2-imidazol-1-ylethoxy)-7-(2-methoxyethoxy)quinazolin-4-yl]amine dihydrochloride Formula: C24H25Cl2N5O3 MolecularWeight: 502.393

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OCCN4C=CN=C4.Cl.Cl

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OCCN4C=CN=C4.Cl.Cl

InChI

InChI=1S/C24H23N5O3.2ClH/c1-3-18-5-4-6-19(13-18)28-24-20-14-22(31-10-9-29-8-7-25-17-29)23(32-12-11-30-2)15-21(20)26-16-27-24;;/h1,4-8,13-17H,9-12H2,2H3,(H,26,27,28);2*1H