5-bromanyl-2-[[3-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[[3-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 5-bromo-2-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoic acid CAS Name: 5-bromo-2-[[oxo-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]methyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[3-(2-thenoylamino)benzoyl]amino]benzoic acid Formula: C19H13BrN2O4S MolecularWeight: 445.28652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C19H13BrN2O4S/c20-12-6-7-15(14(10-12)19(25)26)22-17(23)11-3-1-4-13(9-11)21-18(24)16-5-2-8-27-16/h1-10H,(H,21,24)(H,22,23)(H,25,26)