2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylthio]-6-propyl-1H-pyrimidin-4-one Formula: C19H23FN2O3S MolecularWeight: 378.460923

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCCCC2(OCCO2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCCCC2(OCCO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN2O3S/c1-2-4-16-13-17(23)22-18(21-16)26-12-3-9-19(24-10-11-25-19)14-5-7-15(20)8-6-14/h5-8,13H,2-4,9-12H2,1H3,(H,21,22,23)