5-bromanyl-2-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 5-bromo-2-[[4-(thiophene-2-carbonylamino)benzoyl]amino]benzoic acid CAS Name: 5-bromo-2-[[oxo-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]methyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[4-(thiophene-2-carbonylamino)benzoyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[4-(2-thenoylamino)benzoyl]amino]benzoic acid Formula: C19H13BrN2O4S MolecularWeight: 445.28652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

InChI

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