1-(4-methoxyphenyl)-2-(pyrimidin-4-ylmethylsulfanyl)ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-(pyrimidin-4-ylmethylsulfanyl)ethanone Openeye Name: 1-(4-methoxyphenyl)-2-(pyrimidin-4-ylmethylsulfanyl)ethanone CAS Name: 1-(4-methoxyphenyl)-2-(4-pyrimidinylmethylthio)ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-(pyrimidin-4-ylmethylsulfanyl)ethanone Traditional Name: 1-(4-methoxyphenyl)-2-(4-pyrimidylmethylthio)ethanone Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSCC2=NC=NC=C2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSCC2=NC=NC=C2

InChI

InChI=1S/C14H14N2O2S/c1-18-13-4-2-11(3-5-13)14(17)9-19-8-12-6-7-15-10-16-12/h2-7,10H,8-9H2,1H3