3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[(3-oxo-1-piperazinyl)sulfonyl]-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide Formula: C21H18F3N5O4S MolecularWeight: 493.45893

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

InChI

InChI=1S/C21H18F3N5O4S/c22-21(23,24)15-5-6-18(29-9-2-7-26-29)17(12-15)27-20(31)14-3-1-4-16(11-14)34(32,33)28-10-8-25-19(30)13-28/h1-7,9,11-12H,8,10,13H2,(H,25,30)(H,27,31)