N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[2-morpholino-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[2-(4-morpholinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[[2-morpholino-5-(trifluoromethyl)phenyl]thiocarbamoyl]-3-propoxy-benzamide Formula: C22H24F3N3O3S MolecularWeight: 467.50447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C22H24F3N3O3S/c1-2-10-31-17-5-3-4-15(13-17)20(29)27-21(32)26-18-14-16(22(23,24)25)6-7-19(18)28-8-11-30-12-9-28/h3-7,13-14H,2,8-12H2,1H3,(H2,26,27,29,32)