1-[3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone

Systemtic Name: 1-[3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone Openeye Name: 1-[3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone CAS Name: 1-[3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-4-methoxyphenyl]ethanone IUPAC Name: 1-[3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-methoxyphenyl]ethanone Traditional Name: 1-[3-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-4-methoxy-phenyl]ethanone Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=C(C=CC(=C2)C(=O)C)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=C(C=CC(=C2)C(=O)C)OC)C

InChI

InChI=1S/C16H18N2O2S/c1-10-7-11(2)18-16(17-10)21-9-14-8-13(12(3)19)5-6-15(14)20-4/h5-8H,9H2,1-4H3