N-(1,3-benzodioxol-4-yl)-5-(4-methylpiperazin-1-yl)-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-amine trihydrochloride

Systemtic Name: N-(1,3-benzodioxol-4-yl)-5-(4-methylpiperazin-1-yl)-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-amine trihydrochloride Openeye Name: N-(1,3-benzodioxol-4-yl)-5-(4-methylpiperazin-1-yl)-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-amine trihydrochloride CAS Name: N-(1,3-benzodioxol-4-yl)-5-(4-methyl-1-piperazinyl)-7-[2-(1-pyrrolidinyl)ethoxy]-4-quinazolinamine trihydrochloride IUPAC Name: N-(1,3-benzodioxol-4-yl)-5-(4-methylpiperazin-1-yl)-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-amine trihydrochloride Traditional Name: 1,3-benzodioxol-4-yl-[5-(4-methylpiperazino)-7-(2-pyrrolidinoethoxy)quinazolin-4-yl]amine trihydrochloride Formula: C26H35Cl3N6O3 MolecularWeight: 585.9535

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C(=CC(=C2)OCCN4CCCC4)N=CN=C3NC5=C6C(=CC=C5)OCO6.Cl.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C2=C3C(=CC(=C2)OCCN4CCCC4)N=CN=C3NC5=C6C(=CC=C5)OCO6.Cl.Cl.Cl

InChI

InChI=1S/C26H32N6O3.3ClH/c1-30-9-11-32(12-10-30)22-16-19(33-14-13-31-7-2-3-8-31)15-21-24(22)26(28-17-27-21)29-20-5-4-6-23-25(20)35-18-34-23;;;/h4-6,15-17H,2-3,7-14,18H2,1H3,(H,27,28,29);3*1H