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

Systemtic Name: 1-(4-methylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(p-tolyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(4-methylphenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(4-methylphenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(p-tolyl)-2-(2-pyrimidylthio)ethanone Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C13H12N2OS/c1-10-3-5-11(6-4-10)12(16)9-17-13-14-7-2-8-15-13/h2-8H,9H2,1H3