5-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-2-oxidanyl-benzoate

Systemtic Name: 5-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-2-oxidanyl-benzoate Openeye Name: 5-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-2-hydroxy-benzoate CAS Name: 5-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-2-hydroxybenzoate IUPAC Name: 5-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoate Traditional Name: 5-[[2-(1H-benzimidazol-2-ylthio)acetyl]amino]-2-hydroxy-benzoate Formula: C16H12N3O4S- MolecularWeight: 342.34918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-13-6-5-9(7-10(13)15(22)23)17-14(21)8-24-16-18-11-3-1-2-4-12(11)19-16/h1-7,20H,8H2,(H,17,21)(H,18,19)(H,22,23)/p-1