3-(1-propylbenzimidazol-2-yl)sulfanylpropanoic acid

Systemtic Name: 3-(1-propylbenzimidazol-2-yl)sulfanylpropanoic acid Openeye Name: 3-(1-propylbenzimidazol-2-yl)sulfanylpropanoic acid CAS Name: 3-[(1-propyl-2-benzimidazolyl)thio]propanoic acid IUPAC Name: 3-(1-propylbenzimidazol-2-yl)sulfanylpropanoic acid Traditional Name: 3-[(1-propylbenzimidazol-2-yl)thio]propionic acid Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1SCCC(=O)O

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1SCCC(=O)O

InChI

InChI=1S/C13H16N2O2S/c1-2-8-15-11-6-4-3-5-10(11)14-13(15)18-9-7-12(16)17/h3-6H,2,7-9H2,1H3,(H,16,17)