3-[5-[(E)-(methylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid

Systemtic Name: 3-[5-[(E)-(methylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid Openeye Name: 3-[5-[(E)-(methylcarbamothioylhydrazono)methyl]-2-furyl]benzoic acid CAS Name: 3-[5-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-furanyl]benzoic acid IUPAC Name: 3-[5-[(E)-(methylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid Traditional Name: 3-[5-[(E)-(methylthiocarbamoylhydrazono)methyl]-2-furyl]benzoic acid Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC=C(O1)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CNC(=S)N/N=C/C1=CC=C(O1)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C14H13N3O3S/c1-15-14(21)17-16-8-11-5-6-12(20-11)9-3-2-4-10(7-9)13(18)19/h2-8H,1H3,(H,18,19)(H2,15,17,21)/b16-8+