3,5-bis(dimethylcarbamothioylsulfanyl)benzoic acid

Systemtic Name: 3,5-bis(dimethylcarbamothioylsulfanyl)benzoic acid Openeye Name: 3,5-bis(dimethylcarbamothioylsulfanyl)benzoic acid CAS Name: 3,5-bis[[dimethylamino(sulfanylidene)methyl]thio]benzoic acid IUPAC Name: 3,5-bis(dimethylcarbamothioylsulfanyl)benzoic acid Traditional Name: 3,5-bis(dimethylthiocarbamoylthio)benzoic acid Formula: C13H16N2O2S4 MolecularWeight: 360.53834

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SC1=CC(=CC(=C1)C(=O)O)SC(=S)N(C)C

Isomeric SMILES

CN(C)C(=S)SC1=CC(=CC(=C1)C(=O)O)SC(=S)N(C)C

InChI

InChI=1S/C13H16N2O2S4/c1-14(2)12(18)20-9-5-8(11(16)17)6-10(7-9)21-13(19)15(3)4/h5-7H,1-4H3,(H,16,17)