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

Systemtic Name: 2-[(4-propan-2-yl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-isopropyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]acetic acid CAS Name: 2-[(4-propan-2-yl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]acetic acid IUPAC Name: 2-[(4-propan-2-yl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-isopropyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]acetic acid Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2N3C1=NN=C3SCC(=O)O

Isomeric SMILES

CC(C)N1C2=CC=CC=C2N3C1=NN=C3SCC(=O)O

InChI

InChI=1S/C13H14N4O2S/c1-8(2)16-9-5-3-4-6-10(9)17-12(16)14-15-13(17)20-7-11(18)19/h3-6,8H,7H2,1-2H3,(H,18,19)