1-(4-methylphenyl)-2-pyrimidin-2-ylsulfanyl-propan-1-one

Systemtic Name: 1-(4-methylphenyl)-2-pyrimidin-2-ylsulfanyl-propan-1-one Openeye Name: 1-(p-tolyl)-2-pyrimidin-2-ylsulfanyl-propan-1-one CAS Name: 1-(4-methylphenyl)-2-(2-pyrimidinylthio)-1-propanone IUPAC Name: 1-(4-methylphenyl)-2-pyrimidin-2-ylsulfanylpropan-1-one Traditional Name: 1-(p-tolyl)-2-(2-pyrimidylthio)propan-1-one Formula: C14H14N2OS MolecularWeight: 258.33876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC=CC=N2

InChI

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