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

Systemtic Name: 2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[3-[3-(piperidinomethyl)phenoxy]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC3=NC=C(C(=O)N3)CC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC3=NC=C(C(=O)N3)CC4=CN=CC=C4

InChI

InChI=1S/C25H31N5O2/c31-24-22(15-20-8-5-10-26-17-20)18-28-25(29-24)27-11-6-14-32-23-9-4-7-21(16-23)19-30-12-2-1-3-13-30/h4-5,7-10,16-18H,1-3,6,11-15,19H2,(H2,27,28,29,31)