1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethanone Openeye Name: 1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethanone CAS Name: 1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethanone Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC=CC=N2

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC=CC=N2

InChI

InChI=1S/C14H14N2O2S/c1-10(17)11-4-5-13(18-2)12(8-11)9-19-14-15-6-3-7-16-14/h3-8H,9H2,1-2H3