5-[3-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-[3-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylic acid CAS Name: 5-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(1,2,4-triazol-1-yl)propanoylamino]thiophene-2-carboxylic acid Traditional Name: 5-[3-(1,2,4-triazol-1-yl)propanoylamino]-2-thenoic acid Formula: C10H10N4O3S MolecularWeight: 266.2764

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)NC(=O)CCN2C=NC=N2)C(=O)O

Isomeric SMILES

C1=C(SC(=C1)NC(=O)CCN2C=NC=N2)C(=O)O

InChI

InChI=1S/C10H10N4O3S/c15-8(3-4-14-6-11-5-12-14)13-9-2-1-7(18-9)10(16)17/h1-2,5-6H,3-4H2,(H,13,15)(H,16,17)