2-nitro-4-[(Z)-[[2-(trifluoromethyl)phenyl]carbamothioylhydrazinylidene]methyl]phenolate

Systemtic Name: 2-nitro-4-[(Z)-[[2-(trifluoromethyl)phenyl]carbamothioylhydrazinylidene]methyl]phenolate Openeye Name: 2-nitro-4-[(Z)-[[2-(trifluoromethyl)phenyl]carbamothioylhydrazono]methyl]phenolate CAS Name: 2-nitro-4-[(Z)-[[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]hydrazinylidene]methyl]phenolate IUPAC Name: 2-nitro-4-[(Z)-[[2-(trifluoromethyl)phenyl]carbamothioylhydrazinylidene]methyl]phenolate Traditional Name: 2-nitro-4-[(Z)-[[2-(trifluoromethyl)phenyl]thiocarbamoylhydrazono]methyl]phenolate Formula: C15H10F3N4O3S- MolecularWeight: 383.32511

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=S)NN=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=S)N/N=C\C2=CC(=C(C=C2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11F3N4O3S/c16-15(17,18)10-3-1-2-4-11(10)20-14(26)21-19-8-9-5-6-13(23)12(7-9)22(24)25/h1-8,23H,(H2,20,21,26)/p-1/b19-8-