1-(2,4-dimethylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(2,4-dimethylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(2,4-dimethylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(2,4-dimethylphenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(2,4-dimethylphenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(2,4-dimethylphenyl)-2-(2-pyrimidylthio)ethanone Formula: C14H14N2OS MolecularWeight: 258.33876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2OS/c1-10-4-5-12(11(2)8-10)13(17)9-18-14-15-6-3-7-16-14/h3-8H,9H2,1-2H3