N-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamothioyl]-4-nitro-benzamide Openeye Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-4-nitro-benzamide CAS Name: N-[[2-chloro-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-4-nitrobenzamide Traditional Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]thiocarbamoyl]-4-nitro-benzamide Formula: C15H9ClF3N3O3S MolecularWeight: 403.76347

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H9ClF3N3O3S/c16-11-6-3-9(15(17,18)19)7-12(11)20-14(26)21-13(23)8-1-4-10(5-2-8)22(24)25/h1-7H,(H2,20,21,23,26)