4-ethoxy-3-nitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-ethoxy-3-nitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-ethoxy-3-nitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 4-ethoxy-3-nitro-N-[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]benzamide IUPAC Name: 4-ethoxy-3-nitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-ethoxy-3-nitro-N-[[2-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C17H14F3N3O4S MolecularWeight: 413.37097

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14F3N3O4S/c1-2-27-14-8-7-10(9-13(14)23(25)26)15(24)22-16(28)21-12-6-4-3-5-11(12)17(18,19)20/h3-9H,2H2,1H3,(H2,21,22,24,28)