(E)-N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[[2-morpholino-5-(trifluoromethyl)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[2-(4-morpholinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[[2-morpholino-5-(trifluoromethyl)phenyl]thiocarbamoyl]-3-phenyl-acrylamide Formula: C21H20F3N3O2S MolecularWeight: 435.46261

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H20F3N3O2S/c22-21(23,24)16-7-8-18(27-10-12-29-13-11-27)17(14-16)25-20(30)26-19(28)9-6-15-4-2-1-3-5-15/h1-9,14H,10-13H2,(H2,25,26,28,30)/b9-6+