[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl] methanesulfonate

Systemtic Name: [4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl] methanesulfonate Openeye Name: [4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl] ester IUPAC Name: [4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl] ester Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)OS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)OS(=O)(=O)C)C

InChI

InChI=1S/C13H14N2O3S2/c1-9-8-10(2)15-13(14-9)19-12-6-4-11(5-7-12)18-20(3,16)17/h4-8H,1-3H3