1-(2-methylsulfanylpyrimidin-4-yl)-2-phenyl-ethanone

Systemtic Name: 1-(2-methylsulfanylpyrimidin-4-yl)-2-phenyl-ethanone Openeye Name: 1-(2-methylsulfanylpyrimidin-4-yl)-2-phenyl-ethanone CAS Name: 1-[2-(methylthio)-4-pyrimidinyl]-2-phenylethanone IUPAC Name: 1-(2-methylsulfanylpyrimidin-4-yl)-2-phenylethanone Traditional Name: 1-[2-(methylthio)pyrimidin-4-yl]-2-phenyl-ethanone Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C(=O)CC2=CC=CC=C2

Isomeric SMILES

CSC1=NC=CC(=N1)C(=O)CC2=CC=CC=C2

InChI

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