2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]benzoic acid

Systemtic Name: 2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]benzoic acid Openeye Name: 2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]benzoic acid CAS Name: 2-[2-(1H-1,2,4-triazol-5-ylthio)ethoxy]benzoic acid IUPAC Name: 2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]benzoic acid Traditional Name: 2-[2-(1H-1,2,4-triazol-5-ylthio)ethoxy]benzoic acid Formula: C11H11N3O3S MolecularWeight: 265.28834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)OCCSC2=NC=NN2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)OCCSC2=NC=NN2

InChI

InChI=1S/C11H11N3O3S/c15-10(16)8-3-1-2-4-9(8)17-5-6-18-11-12-7-13-14-11/h1-4,7H,5-6H2,(H,15,16)(H,12,13,14)