6-(2,3-dihydro-1-benzofuran-5-yl)-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-(2,3-dihydro-1-benzofuran-5-yl)-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-(2,3-dihydrobenzofuran-5-yl)-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-(2,3-dihydrobenzofuran-5-yl)-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-(2,3-dihydro-1-benzofuran-5-yl)-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-coumaran-5-yl-2-(methylthio)-1H-pyrimidin-4-one Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C=C(N1)C2=CC3=C(C=C2)OCC3

Isomeric SMILES

CSC1=NC(=O)C=C(N1)C2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C13H12N2O2S/c1-18-13-14-10(7-12(16)15-13)8-2-3-11-9(6-8)4-5-17-11/h2-3,6-7H,4-5H2,1H3,(H,14,15,16)