1-pyridin-3-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 1-pyridin-3-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 1-(3-pyridyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 1-(3-pyridinyl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-pyridin-3-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 1-(3-pyridyl)-4-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CN=CC=C2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CN=CC=C2)C3=NC=CC=N3

InChI

InChI=1S/C17H21N5O/c23-16(15-4-1-6-18-14-15)5-2-9-21-10-12-22(13-11-21)17-19-7-3-8-20-17/h1,3-4,6-8,14H,2,5,9-13H2