N-[(1-phenylpyrazol-4-yl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(1-phenylpyrazol-4-yl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(1-phenylpyrazol-4-yl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide CAS Name: N-[(1-phenyl-4-pyrazolyl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(1-phenylpyrazol-4-yl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-[(1-phenylpyrazol-4-yl)methyl]-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Formula: C22H22F3N5O3S MolecularWeight: 493.50199

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H22F3N5O3S/c23-22(24,25)19-8-4-5-9-20(19)34(32,33)29-12-10-28(11-13-29)21(31)26-14-17-15-27-30(16-17)18-6-2-1-3-7-18/h1-9,15-16H,10-14H2,(H,26,31)