1-(2-adamantyl)-4-[1-[bis(fluoranyl)methyl]-5-methyl-pyrazol-4-yl]sulfonyl-piperazine

Systemtic Name: 1-(2-adamantyl)-4-[1-[bis(fluoranyl)methyl]-5-methyl-pyrazol-4-yl]sulfonyl-piperazine Openeye Name: 1-(2-adamantyl)-4-[1-(difluoromethyl)-5-methyl-pyrazol-4-yl]sulfonyl-piperazine CAS Name: 1-(2-adamantyl)-4-[[1-(difluoromethyl)-5-methyl-4-pyrazolyl]sulfonyl]piperazine IUPAC Name: 1-(2-adamantyl)-4-[1-(difluoromethyl)-5-methylpyrazol-4-yl]sulfonylpiperazine Traditional Name: 1-(2-adamantyl)-4-[1-(difluoromethyl)-5-methyl-pyrazol-4-yl]sulfonyl-piperazine Formula: C19H28F2N4O2S MolecularWeight: 414.513026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C(F)F)S(=O)(=O)N2CCN(CC2)C3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC1=C(C=NN1C(F)F)S(=O)(=O)N2CCN(CC2)C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C19H28F2N4O2S/c1-12-17(11-22-25(12)19(20)21)28(26,27)24-4-2-23(3-5-24)18-15-7-13-6-14(9-15)10-16(18)8-13/h11,13-16,18-19H,2-10H2,1H3