6,7-dimethoxy-2,4-bis(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indole

Systemtic Name: 6,7-dimethoxy-2,4-bis(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indole Openeye Name: 6,7-dimethoxy-2,4-bis(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indole CAS Name: 6,7-dimethoxy-2,4-bis(4-methyl-1-piperazinyl)-9H-pyrimido[4,5-b]indole IUPAC Name: 6,7-dimethoxy-2,4-bis(4-methylpiperazin-1-yl)-9H-pyrimido[4,5-b]indole Traditional Name: 6,7-dimethoxy-2,4-bis(4-methylpiperazino)-9H-pyrimid[4,5-b]indole Formula: C22H31N7O2 MolecularWeight: 425.52724

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC3=C2C4=CC(=C(C=C4N3)OC)OC)N5CCN(CC5)C

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC3=C2C4=CC(=C(C=C4N3)OC)OC)N5CCN(CC5)C

InChI

InChI=1S/C22H31N7O2/c1-26-5-9-28(10-6-26)21-19-15-13-17(30-3)18(31-4)14-16(15)23-20(19)24-22(25-21)29-11-7-27(2)8-12-29/h13-14H,5-12H2,1-4H3,(H,23,24,25)