2-[8-(4-fluorophenyl)non-8-enylsulfanyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[8-(4-fluorophenyl)non-8-enylsulfanyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[8-(4-fluorophenyl)non-8-enylsulfanyl]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[8-(4-fluorophenyl)non-8-enylthio]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[8-(4-fluorophenyl)non-8-enylsulfanyl]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[8-(4-fluorophenyl)non-8-enylthio]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C25H28FN3OS MolecularWeight: 437.572723

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CCCCCCCSC1=NC=C(C(=O)N1)CC2=CN=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C=C(CCCCCCCSC1=NC=C(C(=O)N1)CC2=CN=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C25H28FN3OS/c1-19(21-10-12-23(26)13-11-21)8-5-3-2-4-6-15-31-25-28-18-22(24(30)29-25)16-20-9-7-14-27-17-20/h7,9-14,17-18H,1-6,8,15-16H2,(H,28,29,30)