N-[2-(1-benzofuran-2-yl)-6-bromanyl-quinazolin-4-yl]-N',N'-dimethyl-propane-1,3-diamine

Systemtic Name: N-[2-(1-benzofuran-2-yl)-6-bromanyl-quinazolin-4-yl]-N',N'-dimethyl-propane-1,3-diamine Openeye Name: N-[2-(benzofuran-2-yl)-6-bromo-quinazolin-4-yl]-N',N'-dimethyl-propane-1,3-diamine CAS Name: N-[2-(2-benzofuranyl)-6-bromo-4-quinazolinyl]-N',N'-dimethylpropane-1,3-diamine IUPAC Name: N-[2-(1-benzofuran-2-yl)-6-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine Traditional Name: 3-[[2-(benzofuran-2-yl)-6-bromo-quinazolin-4-yl]amino]propyl-dimethyl-amine Formula: C21H21BrN4O MolecularWeight: 425.32164

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC(=NC2=C1C=C(C=C2)Br)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CN(C)CCCNC1=NC(=NC2=C1C=C(C=C2)Br)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H21BrN4O/c1-26(2)11-5-10-23-20-16-13-15(22)8-9-17(16)24-21(25-20)19-12-14-6-3-4-7-18(14)27-19/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,23,24,25)