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

Systemtic Name: 7-methoxy-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one CAS Name: 7-methoxy-3-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[2-(4-benzylpiperazino)ethyl]-7-methoxy-5H-pyrimid[5,4-b]indol-4-one Formula: C24H27N5O2 MolecularWeight: 417.50348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)CCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)CCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C24H27N5O2/c1-31-19-7-8-20-21(15-19)26-23-22(20)25-17-29(24(23)30)14-13-27-9-11-28(12-10-27)16-18-5-3-2-4-6-18/h2-8,15,17,26H,9-14,16H2,1H3