2-acetamido-3-(1,2,3-triazol-1-ylsulfanyl)benzoic acid

Systemtic Name: 2-acetamido-3-(1,2,3-triazol-1-ylsulfanyl)benzoic acid Openeye Name: 2-acetamido-3-(triazol-1-ylsulfanyl)benzoic acid CAS Name: 2-acetamido-3-(1-triazolylthio)benzoic acid IUPAC Name: 2-acetamido-3-(triazol-1-ylsulfanyl)benzoic acid Traditional Name: 2-acetamido-3-(triazol-1-ylthio)benzoic acid Formula: C11H10N4O3S MolecularWeight: 278.2871

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC=C1SN2C=CN=N2)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=CC=C1SN2C=CN=N2)C(=O)O

InChI

InChI=1S/C11H10N4O3S/c1-7(16)13-10-8(11(17)18)3-2-4-9(10)19-15-6-5-12-14-15/h2-6H,1H3,(H,13,16)(H,17,18)