2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfinyl]ethanoic acid

Systemtic Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfinyl]ethanoic acid Openeye Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfinyl]acetic acid CAS Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfinyl]acetic acid IUPAC Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfinyl]acetic acid Traditional Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfinyl]acetic acid Formula: C10H9N3O3S MolecularWeight: 251.26176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=N2)S(=O)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=N2)S(=O)CC(=O)O

InChI

InChI=1S/C10H9N3O3S/c14-8(15)6-17(16)10-11-9(12-13-10)7-4-2-1-3-5-7/h1-5H,6H2,(H,14,15)(H,11,12,13)