N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[[2-morpholino-5-(trifluoromethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[[2-(4-morpholinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[[2-morpholino-5-(trifluoromethyl)phenyl]thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C20H19F3N4O5S MolecularWeight: 484.44887

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19F3N4O5S/c21-20(22,23)13-1-6-17(26-7-9-31-10-8-26)16(11-13)24-19(33)25-18(28)12-32-15-4-2-14(3-5-15)27(29)30/h1-6,11H,7-10,12H2,(H2,24,25,28,33)