1-[4-[4-(5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(5H-pyrimido[5,4-b]indol-4-yl)-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(5H-pyrimid[5,4-b]indol-4-yl)piperazino]phenyl]ethanone Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC=NC4=C3NC5=CC=CC=C54

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC=NC4=C3NC5=CC=CC=C54

InChI

InChI=1S/C22H21N5O/c1-15(28)16-6-8-17(9-7-16)26-10-12-27(13-11-26)22-21-20(23-14-24-22)18-4-2-3-5-19(18)25-21/h2-9,14,25H,10-13H2,1H3