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

Systemtic Name: 2-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(benzofuran-2-yl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2-benzofuranyl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(1-benzofuran-2-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(benzofuran-2-yl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C17H16N2O3S/c1-2-5-12-9-16(21)19-17(18-12)23-10-13(20)15-8-11-6-3-4-7-14(11)22-15/h3-4,6-9H,2,5,10H2,1H3,(H,18,19,21)