tert-butyl 4-[1-[bis(fluoranyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-[bis(fluoranyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(difluoromethyl)-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[[1-(difluoromethyl)-3,5-dimethyl-4-pyrazolyl]sulfonyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(difluoromethyl)-3,5-dimethylpyrazol-4-yl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[1-(difluoromethyl)-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C15H24F2N4O4S MolecularWeight: 394.437266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(F)F)C)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1C(F)F)C)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H24F2N4O4S/c1-10-12(11(2)21(18-10)13(16)17)26(23,24)20-8-6-19(7-9-20)14(22)25-15(3,4)5/h13H,6-9H2,1-5H3