6-(piperidin-1-ylmethyl)-2-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-(piperidin-1-ylmethyl)-2-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]-1H-pyrimidin-4-one Openeye Name: 6-(1-piperidylmethyl)-2-[4-[2-(2-thienyl)acetyl]piperazin-1-yl]-1H-pyrimidin-4-one CAS Name: 2-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-6-(1-piperidinylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-(piperidin-1-ylmethyl)-2-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]-1H-pyrimidin-4-one Traditional Name: 6-(piperidinomethyl)-2-[4-[2-(2-thienyl)acetyl]piperazino]-1H-pyrimidin-4-one Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)CC4=CC=CS4

Isomeric SMILES

C1CCN(CC1)CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C20H27N5O2S/c26-18-13-16(15-23-6-2-1-3-7-23)21-20(22-18)25-10-8-24(9-11-25)19(27)14-17-5-4-12-28-17/h4-5,12-13H,1-3,6-11,14-15H2,(H,21,22,26)