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

Systemtic Name: 3-[(4-phenyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]propanoic acid Openeye Name: 3-[(4-phenyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]propanoic acid CAS Name: 3-[(4-phenyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]propanoic acid IUPAC Name: 3-[(4-phenyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]propanoic acid Traditional Name: 3-[(4-phenyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]propionic acid Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3N4C2=NN=C4SCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3N4C2=NN=C4SCCC(=O)O

InChI

InChI=1S/C17H14N4O2S/c22-15(23)10-11-24-17-19-18-16-20(12-6-2-1-3-7-12)13-8-4-5-9-14(13)21(16)17/h1-9H,10-11H2,(H,22,23)