2-(1H-benzimidazol-2-ylmethylsulfanyl)propanoic acid

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)propanoic acid Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)propanoic acid CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)propanoic acid IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)propanoic acid Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)propionic acid Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(C(=O)O)SCC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C11H12N2O2S/c1-7(11(14)15)16-6-10-12-8-4-2-3-5-9(8)13-10/h2-5,7H,6H2,1H3,(H,12,13)(H,14,15)