4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]benzoic acid

Systemtic Name: 4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]benzoic acid Openeye Name: 4-[(E)-(methylcarbamothioylhydrazono)methyl]benzoic acid CAS Name: 4-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]benzoic acid Traditional Name: 4-[(E)-(methylthiocarbamoylhydrazono)methyl]benzoic acid Formula: C10H11N3O2S MolecularWeight: 237.27824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O2S/c1-11-10(16)13-12-6-7-2-4-8(5-3-7)9(14)15/h2-6H,1H3,(H,14,15)(H2,11,13,16)/b12-6+