2-[[4-(2,3-dihydro-1H-inden-5-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(2,3-dihydro-1H-inden-5-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[(4-indan-5-yl-1,2,4-triazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[[4-(2,3-dihydro-1H-inden-5-yl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(2,3-dihydro-1H-inden-5-yl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[(4-indan-5-yl-1,2,4-triazol-3-yl)thio]acetic acid Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)N3C=NN=C3SCC(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)N3C=NN=C3SCC(=O)O

InChI

InChI=1S/C13H13N3O2S/c17-12(18)7-19-13-15-14-8-16(13)11-5-4-9-2-1-3-10(9)6-11/h4-6,8H,1-3,7H2,(H,17,18)