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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC2=C1C3=CC(=C(C=C3N2)OC)OC)CN4CCN(CC4)C

Isomeric SMILES

CCN(CC)C1=NC(=NC2=C1C3=CC(=C(C=C3N2)OC)OC)CN4CCN(CC4)C

InChI

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