3-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[2-[4-(2-ethoxyphenyl)-1-piperazinyl]ethyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-methyl-3-[2-(4-o-phenetylpiperazino)ethyl]-5H-pyrimid[5,4-b]indol-4-one Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CCN3C(=NC4=C(C3=O)NC5=CC=CC=C54)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CCN3C(=NC4=C(C3=O)NC5=CC=CC=C54)C

InChI

InChI=1S/C25H29N5O2/c1-3-32-22-11-7-6-10-21(22)29-15-12-28(13-16-29)14-17-30-18(2)26-23-19-8-4-5-9-20(19)27-24(23)25(30)31/h4-11,27H,3,12-17H2,1-2H3