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

Systemtic Name: tert-butyl 4-[1-[bis(fluoranyl)methyl]-5-methyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(difluoromethyl)-5-methyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[[1-(difluoromethyl)-5-methyl-4-pyrazolyl]sulfonyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(difluoromethyl)-5-methylpyrazol-4-yl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[1-(difluoromethyl)-5-methyl-pyrazol-4-yl]sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C14H22F2N4O4S MolecularWeight: 380.410686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22F2N4O4S/c1-10-11(9-17-20(10)12(15)16)25(22,23)19-7-5-18(6-8-19)13(21)24-14(2,3)4/h9,12H,5-8H2,1-4H3