1-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl]ethanone

Systemtic Name: 1-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl]ethanone Openeye Name: 1-[3,5-dimethyl-1-(p-tolylsulfonyl)pyrazol-4-yl]ethanone CAS Name: 1-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-4-pyrazolyl]ethanone IUPAC Name: 1-[3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazol-4-yl]ethanone Traditional Name: 1-(3,5-dimethyl-1-tosyl-pyrazol-4-yl)ethanone Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)C(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)C(=O)C)C

InChI

InChI=1S/C14H16N2O3S/c1-9-5-7-13(8-6-9)20(18,19)16-11(3)14(12(4)17)10(2)15-16/h5-8H,1-4H3