1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone Openeye Name: 1-[4-(p-tolylsulfonyl)piperazin-1-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-[3-(trifluoromethyl)-1-pyrazolyl]ethanone IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone Traditional Name: 1-(4-tosylpiperazino)-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanone Formula: C17H19F3N4O3S MolecularWeight: 416.41797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C=CC(=N3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C=CC(=N3)C(F)(F)F

InChI

InChI=1S/C17H19F3N4O3S/c1-13-2-4-14(5-3-13)28(26,27)24-10-8-22(9-11-24)16(25)12-23-7-6-15(21-23)17(18,19)20/h2-7H,8-12H2,1H3