4-(4-cyclohexylpiperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-(4-cyclohexylpiperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole Openeye Name: 4-(4-cyclohexylpiperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole CAS Name: 4-(4-cyclohexyl-1-piperazinyl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole IUPAC Name: 4-(4-cyclohexylpiperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole Traditional Name: 4-(4-cyclohexylpiperazino)-7,8-dimethoxy-5H-pyrimid[5,4-b]indole Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5CCCCC5)OC

InChI

InChI=1S/C22H29N5O2/c1-28-18-12-16-17(13-19(18)29-2)25-21-20(16)23-14-24-22(21)27-10-8-26(9-11-27)15-6-4-3-5-7-15/h12-15,25H,3-11H2,1-2H3