2-[1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-fluorophenyl)-1-methyl-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[1-(4-fluorophenyl)-1-oxopropan-2-yl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[1-(4-fluorophenyl)-1-oxopropan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-fluorophenyl)-2-keto-1-methyl-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C16H17FN2O2S MolecularWeight: 320.381783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN2O2S/c1-3-4-13-9-14(20)19-16(18-13)22-10(2)15(21)11-5-7-12(17)8-6-11/h5-10H,3-4H2,1-2H3,(H,18,19,20)