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

Systemtic Name: 1-(4-methoxyphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-methoxyphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(4-methoxyphenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(4-methoxyphenyl)-2-(2-pyrimidylthio)ethanone Formula: C13H12N2O2S MolecularWeight: 260.31158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NC=CC=N2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NC=CC=N2

InChI

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