1-[4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]propan-1-one

Systemtic Name: 1-[4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]propan-1-one Openeye Name: 1-[4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]propan-1-one CAS Name: 1-[4-[2-(2-pyrimidinylthio)ethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]propan-1-one Traditional Name: 1-[4-[2-(2-pyrimidylthio)ethoxy]phenyl]propan-1-one Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCCSC2=NC=CC=N2

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCCSC2=NC=CC=N2

InChI

InChI=1S/C15H16N2O2S/c1-2-14(18)12-4-6-13(7-5-12)19-10-11-20-15-16-8-3-9-17-15/h3-9H,2,10-11H2,1H3