4-[2-(furan-2-ylmethylcarbamothioyl)hydrazinyl]benzoate

Systemtic Name: 4-[2-(furan-2-ylmethylcarbamothioyl)hydrazinyl]benzoate Openeye Name: 4-[2-(2-furylmethylcarbamothioyl)hydrazino]benzoate CAS Name: 4-[[(2-furanylmethylamino)-sulfanylidenemethyl]hydrazo]benzoate IUPAC Name: 4-[2-(furan-2-ylmethylcarbamothioyl)hydrazinyl]benzoate Traditional Name: 4-[N'-(2-furfurylthiocarbamoyl)hydrazino]benzoate Formula: C13H12N3O3S- MolecularWeight: 290.31768

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=S)NNC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNC(=S)NNC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C13H13N3O3S/c17-12(18)9-3-5-10(6-4-9)15-16-13(20)14-8-11-2-1-7-19-11/h1-7,15H,8H2,(H,17,18)(H2,14,16,20)/p-1