1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one

Systemtic Name: 1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one Openeye Name: 1-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]pent-4-en-1-one CAS Name: 1-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-4-penten-1-one IUPAC Name: 1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one Traditional Name: 1-[4-(6-piperidinopyrimidin-4-yl)piperazino]pent-4-en-1-one Formula: C18H27N5O MolecularWeight: 329.43988

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=O)N1CCN(CC1)C2=NC=NC(=C2)N3CCCCC3

Isomeric SMILES

C=CCCC(=O)N1CCN(CC1)C2=NC=NC(=C2)N3CCCCC3

InChI

InChI=1S/C18H27N5O/c1-2-3-7-18(24)23-12-10-22(11-13-23)17-14-16(19-15-20-17)21-8-5-4-6-9-21/h2,14-15H,1,3-13H2