2-methyl-5-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]sulfonyl-benzamide

Systemtic Name: 2-methyl-5-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]sulfonyl-benzamide Openeye Name: 2-methyl-5-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]sulfonyl-benzamide CAS Name: 2-methyl-5-[[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 2-methyl-5-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]sulfonylbenzamide Traditional Name: 2-methyl-5-[4-[4-(trifluoromethyl)benzoyl]piperazino]sulfonyl-benzamide Formula: C20H20F3N3O4S MolecularWeight: 455.45071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F)C(=O)N

InChI

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