2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]thio]acetic acid Formula: C10H11N3O2S2 MolecularWeight: 269.34324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCN2C=NN=C2SCC(=O)O

Isomeric SMILES

C1=CSC(=C1)CCN2C=NN=C2SCC(=O)O

InChI

InChI=1S/C10H11N3O2S2/c14-9(15)6-17-10-12-11-7-13(10)4-3-8-2-1-5-16-8/h1-2,5,7H,3-4,6H2,(H,14,15)