5-bromanyl-2-(2-phenylsulfanylethanoylamino)benzoic acid

Systemtic Name: 5-bromanyl-2-(2-phenylsulfanylethanoylamino)benzoic acid Openeye Name: 5-bromo-2-[(2-phenylsulfanylacetyl)amino]benzoic acid CAS Name: 5-bromo-2-[[1-oxo-2-(phenylthio)ethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[(2-phenylsulfanylacetyl)amino]benzoic acid Traditional Name: 5-bromo-2-[[2-(phenylthio)acetyl]amino]benzoic acid Formula: C15H12BrNO3S MolecularWeight: 366.22968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C15H12BrNO3S/c16-10-6-7-13(12(8-10)15(19)20)17-14(18)9-21-11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18)(H,19,20)