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

Systemtic Name: 2-[4-(phenylmethyl)piperidin-1-yl]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-(4-benzyl-1-piperidyl)-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(phenylmethyl)-1-piperidinyl]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzylpiperidin-1-yl)-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-(4-benzylpiperidino)-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NC(=O)C=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NC(=O)C=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C21H22N4O/c26-20-15-19(18-6-10-22-11-7-18)23-21(24-20)25-12-8-17(9-13-25)14-16-4-2-1-3-5-16/h1-7,10-11,15,17H,8-9,12-14H2,(H,23,24,26)