5-[2-(1,2,4-triazol-1-yl)ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[2-(1,2,4-triazol-1-yl)ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-[[2-(1,2,4-triazol-1-yl)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[2-(1,2,4-triazol-1-yl)acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[2-(1,2,4-triazol-1-yl)acetyl]amino]-2-thenoic acid Formula: C9H8N4O3S MolecularWeight: 252.24982

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)NC(=O)CN2C=NC=N2)C(=O)O

Isomeric SMILES

C1=C(SC(=C1)NC(=O)CN2C=NC=N2)C(=O)O

InChI

InChI=1S/C9H8N4O3S/c14-7(3-13-5-10-4-11-13)12-8-2-1-6(17-8)9(15)16/h1-2,4-5H,3H2,(H,12,14)(H,15,16)