2-[4-[4-(piperidin-1-ylmethyl)phenoxy]butyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[4-[4-(piperidin-1-ylmethyl)phenoxy]butyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[4-[4-(1-piperidylmethyl)phenoxy]butyl]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[4-[4-(1-piperidinylmethyl)phenoxy]butyl]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[4-[4-(piperidin-1-ylmethyl)phenoxy]butyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[4-[4-(piperidinomethyl)phenoxy]butyl]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)OCCCCC3=NC=C(C(=O)N3)CC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)OCCCCC3=NC=C(C(=O)N3)CC4=CN=CC=C4

InChI

InChI=1S/C26H32N4O2/c31-26-23(17-22-7-6-13-27-18-22)19-28-25(29-26)8-2-5-16-32-24-11-9-21(10-12-24)20-30-14-3-1-4-15-30/h6-7,9-13,18-19H,1-5,8,14-17,20H2,(H,28,29,31)