4,5-bis(fluoranyl)-2-(methylsulfanylcarbothioylamino)benzoic acid

Systemtic Name: 4,5-bis(fluoranyl)-2-(methylsulfanylcarbothioylamino)benzoic acid Openeye Name: 4,5-difluoro-2-(methylsulfanylcarbothioylamino)benzoic acid CAS Name: 4,5-difluoro-2-[[(methylthio)-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4,5-difluoro-2-(methylsulfanylcarbothioylamino)benzoic acid Traditional Name: 4,5-difluoro-2-[(methylthio)carbothioylamino]benzoic acid Formula: C9H7F2NO2S2 MolecularWeight: 263.284186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)NC1=CC(=C(C=C1C(=O)O)F)F

Isomeric SMILES

CSC(=S)NC1=CC(=C(C=C1C(=O)O)F)F

InChI

InChI=1S/C9H7F2NO2S2/c1-16-9(15)12-7-3-6(11)5(10)2-4(7)8(13)14/h2-3H,1H3,(H,12,15)(H,13,14)