1-[4-(2,3-dihydro-1-benzofuran-5-yl)pyrimidin-2-yl]sulfanylpropan-2-one

Systemtic Name: 1-[4-(2,3-dihydro-1-benzofuran-5-yl)pyrimidin-2-yl]sulfanylpropan-2-one Openeye Name: 1-[4-(2,3-dihydrobenzofuran-5-yl)pyrimidin-2-yl]sulfanylpropan-2-one CAS Name: 1-[[4-(2,3-dihydrobenzofuran-5-yl)-2-pyrimidinyl]thio]-2-propanone IUPAC Name: 1-[4-(2,3-dihydro-1-benzofuran-5-yl)pyrimidin-2-yl]sulfanylpropan-2-one Traditional Name: 1-[(4-coumaran-5-ylpyrimidin-2-yl)thio]acetone Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O2S/c1-10(18)9-20-15-16-6-4-13(17-15)11-2-3-14-12(8-11)5-7-19-14/h2-4,6,8H,5,7,9H2,1H3