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

Systemtic Name: 6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-2-[(4-methylpiperazin-1-yl)methyl]-9H-pyrimido[4,5-b]indole Openeye Name: 6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-2-[(4-methylpiperazin-1-yl)methyl]-9H-pyrimido[4,5-b]indole CAS Name: 6,7-dimethoxy-4-(4-methyl-1-piperazinyl)-2-[(4-methyl-1-piperazinyl)methyl]-9H-pyrimido[4,5-b]indole IUPAC Name: 6,7-dimethoxy-4-(4-methylpiperazin-1-yl)-2-[(4-methylpiperazin-1-yl)methyl]-9H-pyrimido[4,5-b]indole Traditional Name: 6,7-dimethoxy-4-(4-methylpiperazino)-2-[(4-methylpiperazino)methyl]-9H-pyrimid[4,5-b]indole Formula: C23H33N7O2 MolecularWeight: 439.55382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NC3=C(C4=CC(=C(C=C4N3)OC)OC)C(=N2)N5CCN(CC5)C

Isomeric SMILES

CN1CCN(CC1)CC2=NC3=C(C4=CC(=C(C=C4N3)OC)OC)C(=N2)N5CCN(CC5)C

InChI

InChI=1S/C23H33N7O2/c1-27-5-9-29(10-6-27)15-20-25-22-21(23(26-20)30-11-7-28(2)8-12-30)16-13-18(31-3)19(32-4)14-17(16)24-22/h13-14H,5-12,15H2,1-4H3,(H,24,25,26)