N-[[6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indol-2-yl]methyl]-N-ethyl-ethanamine

Systemtic Name: N-[[6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indol-2-yl]methyl]-N-ethyl-ethanamine Openeye Name: N-[[6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indol-2-yl]methyl]-N-ethyl-ethanamine CAS Name: N-[[6,7-dimethoxy-4-(4-methyl-1-piperazinyl)-9H-pyrimido[4,5-b]indol-2-yl]methyl]-N-ethylethanamine IUPAC Name: N-[[6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indol-2-yl]methyl]-N-ethylethanamine Traditional Name: [6,7-dimethoxy-4-(4-methylpiperazino)-9H-pyrimid[4,5-b]indol-2-yl]methyl-diethyl-amine Formula: C22H32N6O2 MolecularWeight: 412.52848

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC2=C(C3=CC(=C(C=C3N2)OC)OC)C(=N1)N4CCN(CC4)C

Isomeric SMILES

CCN(CC)CC1=NC2=C(C3=CC(=C(C=C3N2)OC)OC)C(=N1)N4CCN(CC4)C

InChI

InChI=1S/C22H32N6O2/c1-6-27(7-2)14-19-24-21-20(22(25-19)28-10-8-26(3)9-11-28)15-12-17(29-4)18(30-5)13-16(15)23-21/h12-13H,6-11,14H2,1-5H3,(H,23,24,25)