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

Systemtic Name: 2-[2-(furan-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2-furyl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2-furanyl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(furan-2-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(2-furyl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=CO2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=CO2

InChI

InChI=1S/C13H14N2O3S/c1-2-4-9-7-12(17)15-13(14-9)19-8-10(16)11-5-3-6-18-11/h3,5-7H,2,4,8H2,1H3,(H,14,15,17)