2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoic acid

Systemtic Name: 2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoic acid Openeye Name: 2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoic acid CAS Name: 2-[(1-ethyl-2-benzimidazolyl)thio]propanoic acid IUPAC Name: 2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoic acid Traditional Name: 2-[(1-ethylbenzimidazol-2-yl)thio]propionic acid Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)O

InChI

InChI=1S/C12H14N2O2S/c1-3-14-10-7-5-4-6-9(10)13-12(14)17-8(2)11(15)16/h4-8H,3H2,1-2H3,(H,15,16)