5-(1-benzofuran-2-ylcarbonylcarbamothioylamino)-2-chloranyl-benzoic acid

Systemtic Name: 5-(1-benzofuran-2-ylcarbonylcarbamothioylamino)-2-chloranyl-benzoic acid Openeye Name: 5-(benzofuran-2-carbonylcarbamothioylamino)-2-chloro-benzoic acid CAS Name: 5-[[[[2-benzofuranyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-2-chlorobenzoic acid IUPAC Name: 5-(1-benzofuran-2-carbonylcarbamothioylamino)-2-chlorobenzoic acid Traditional Name: 5-(benzofuran-2-carbonylthiocarbamoylamino)-2-chloro-benzoic acid Formula: C17H11ClN2O4S MolecularWeight: 374.79824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C17H11ClN2O4S/c18-12-6-5-10(8-11(12)16(22)23)19-17(25)20-15(21)14-7-9-3-1-2-4-13(9)24-14/h1-8H,(H,22,23)(H2,19,20,21,25)