4-chloranyl-3-(thiophen-2-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(thiophen-2-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 4-chloro-3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid CAS Name: 4-chloro-3-[[[[oxo(thiophen-2-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid Traditional Name: 4-chloro-3-(2-thenoylthiocarbamoylamino)benzoic acid Formula: C13H9ClN2O3S2 MolecularWeight: 340.80516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C13H9ClN2O3S2/c14-8-4-3-7(12(18)19)6-9(8)15-13(20)16-11(17)10-2-1-5-21-10/h1-6H,(H,18,19)(H2,15,16,17,20)