3,5-bis(iodanyl)-2-(thiophen-2-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 3,5-bis(iodanyl)-2-(thiophen-2-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 3,5-diiodo-2-(thiophene-2-carbonylcarbamothioylamino)benzoic acid CAS Name: 3,5-diiodo-2-[[[[oxo(thiophen-2-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 3,5-diiodo-2-(thiophene-2-carbonylcarbamothioylamino)benzoic acid Traditional Name: 3,5-diiodo-2-(2-thenoylthiocarbamoylamino)benzoic acid Formula: C13H8I2N2O3S2 MolecularWeight: 558.15316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C(=O)O)I)I

Isomeric SMILES

C1=CSC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C(=O)O)I)I

InChI

InChI=1S/C13H8I2N2O3S2/c14-6-4-7(12(19)20)10(8(15)5-6)16-13(21)17-11(18)9-2-1-3-22-9/h1-5H,(H,19,20)(H2,16,17,18,21)