8-methoxy-5-methyl-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrimido[5,4-b]indol-4-one

Systemtic Name: 8-methoxy-5-methyl-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-8-methoxy-5-methyl-pyrimido[5,4-b]indol-4-one CAS Name: 8-methoxy-5-methyl-3-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-4-pyrimido[5,4-b]indolone IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-8-methoxy-5-methylpyrimido[5,4-b]indol-4-one Traditional Name: 3-[2-(4-benzylpiperazino)ethyl]-8-methoxy-5-methyl-pyrimid[5,4-b]indol-4-one Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C=N3)CCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C=N3)CCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H29N5O2/c1-27-22-9-8-20(32-2)16-21(22)23-24(27)25(31)30(18-26-23)15-14-28-10-12-29(13-11-28)17-19-6-4-3-5-7-19/h3-9,16,18H,10-15,17H2,1-2H3