[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] methanesulfonate

Systemtic Name: [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] methanesulfonate Openeye Name: [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(4,6-dimethyl-2-pyrimidinyl)-4-ethyl-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methylpyrazol-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] ester Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C)C2=NC(=CC(=N2)C)C)OS(=O)(=O)C

Isomeric SMILES

CCC1=C(N(N=C1C)C2=NC(=CC(=N2)C)C)OS(=O)(=O)C

InChI

InChI=1S/C13H18N4O3S/c1-6-11-10(4)16-17(12(11)20-21(5,18)19)13-14-8(2)7-9(3)15-13/h7H,6H2,1-5H3