N-(2-methyl-2-morpholin-4-yl-propyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-propyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide Openeye Name: N-(2-methyl-2-morpholino-propyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide CAS Name: N-[2-methyl-2-(4-morpholinyl)propyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide IUPAC Name: N-(2-methyl-2-morpholin-4-ylpropyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylbenzamide Traditional Name: N-(2-methyl-2-morpholino-propyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide Formula: C22H24F3N3O4S MolecularWeight: 483.50387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C22H24F3N3O4S/c1-21(2,27-9-11-32-12-10-27)14-26-20(29)16-5-3-4-6-18(16)33-19-8-7-15(22(23,24)25)13-17(19)28(30)31/h3-8,13H,9-12,14H2,1-2H3,(H,26,29)