(1-phenylpyrazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (1-phenylpyrazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (1-phenylpyrazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (1-phenyl-4-pyrazolyl)-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (1-phenylpyrazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (1-phenylpyrazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C21H19F3N4O3S MolecularWeight: 464.46077

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H19F3N4O3S/c22-21(23,24)18-8-4-5-9-19(18)32(30,31)27-12-10-26(11-13-27)20(29)16-14-25-28(15-16)17-6-2-1-3-7-17/h1-9,14-15H,10-13H2