4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide

Systemtic Name: 4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide Openeye Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide CAS Name: 4-[(3-oxo-1-piperazinyl)sulfonyl]-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide IUPAC Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide Traditional Name: 4-(3-ketopiperazino)sulfonyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide Formula: C20H20F3N3O4S MolecularWeight: 455.45071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(F)(F)F)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC(C1=CC=C(C=C1)C(F)(F)F)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C20H20F3N3O4S/c1-13(14-2-6-16(7-3-14)20(21,22)23)25-19(28)15-4-8-17(9-5-15)31(29,30)26-11-10-24-18(27)12-26/h2-9,13H,10-12H2,1H3,(H,24,27)(H,25,28)