2-[(4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]butanoic acid

Systemtic Name: 2-[(4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]butanoic acid Openeye Name: 2-[(4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]butanoic acid CAS Name: 2-[(4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]butanoic acid IUPAC Name: 2-[(4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]butanoic acid Traditional Name: 2-[(4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]butyric acid Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=NN=C2N1C3=CC=CC=C3N2CC

Isomeric SMILES

CCC(C(=O)O)SC1=NN=C2N1C3=CC=CC=C3N2CC

InChI

InChI=1S/C14H16N4O2S/c1-3-11(12(19)20)21-14-16-15-13-17(4-2)9-7-5-6-8-10(9)18(13)14/h5-8,11H,3-4H2,1-2H3,(H,19,20)