1-(4-methyl-2-oxidanyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-methyl-2-oxidanyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(2-hydroxy-4-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(2-hydroxy-4-methylphenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(2-hydroxy-4-methylphenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(2-hydroxy-4-methyl-phenyl)-2-(2-pyrimidylthio)ethanone Formula: C13H12N2O2S MolecularWeight: 260.31158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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