4-propyl-[1,2,4]triazolo[4,3-a]benzimidazole-1-sulfonic acid

Systemtic Name: 4-propyl-[1,2,4]triazolo[4,3-a]benzimidazole-1-sulfonic acid Openeye Name: 4-propyl-[1,2,4]triazolo[4,3-a]benzimidazole-1-sulfonic acid CAS Name: 4-propyl-[1,2,4]triazolo[4,3-a]benzimidazole-1-sulfonic acid IUPAC Name: 4-propyl-[1,2,4]triazolo[4,3-a]benzimidazole-1-sulfonic acid Traditional Name: 4-propyl-[1,2,4]triazolo[4,3-a]benzimidazole-1-sulfonic acid Formula: C11H12N4O3S MolecularWeight: 280.30298

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N3C1=NN=C3S(=O)(=O)O

Isomeric SMILES

CCCN1C2=CC=CC=C2N3C1=NN=C3S(=O)(=O)O

InChI

InChI=1S/C11H12N4O3S/c1-2-7-14-8-5-3-4-6-9(8)15-10(14)12-13-11(15)19(16,17)18/h3-6H,2,7H2,1H3,(H,16,17,18)