2-[4-(phenylmethyl)piperazin-1-yl]-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-(4-benzylpiperazin-1-yl)-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzylpiperazin-1-yl)-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-(4-benzylpiperazino)-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC(=O)C=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC(=O)C=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C20H21N5O/c26-19-14-18(17-6-8-21-9-7-17)22-20(23-19)25-12-10-24(11-13-25)15-16-4-2-1-3-5-16/h1-9,14H,10-13,15H2,(H,22,23,26)