N',N'-diethyl-N-[2-(4-methoxyphenyl)quinazolin-4-yl]propane-1,3-diamine hydrochloride

Systemtic Name: N',N'-diethyl-N-[2-(4-methoxyphenyl)quinazolin-4-yl]propane-1,3-diamine hydrochloride Openeye Name: N',N'-diethyl-N-[2-(4-methoxyphenyl)quinazolin-4-yl]propane-1,3-diamine hydrochloride CAS Name: N',N'-diethyl-N-[2-(4-methoxyphenyl)-4-quinazolinyl]propane-1,3-diamine hydrochloride IUPAC Name: N',N'-diethyl-N-[2-(4-methoxyphenyl)quinazolin-4-yl]propane-1,3-diamine hydrochloride Traditional Name: diethyl-[3-[[2-(4-methoxyphenyl)quinazolin-4-yl]amino]propyl]amine hydrochloride Formula: C22H29ClN4O MolecularWeight: 400.94486

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC.Cl

Isomeric SMILES

CCN(CC)CCCNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC.Cl

InChI

InChI=1S/C22H28N4O.ClH/c1-4-26(5-2)16-8-15-23-22-19-9-6-7-10-20(19)24-21(25-22)17-11-13-18(27-3)14-12-17;/h6-7,9-14H,4-5,8,15-16H2,1-3H3,(H,23,24,25);1H