2-(1-tert-butylbenzimidazol-2-yl)sulfanylethanoate

Systemtic Name: 2-(1-tert-butylbenzimidazol-2-yl)sulfanylethanoate Openeye Name: 2-(1-tert-butylbenzimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-tert-butyl-2-benzimidazolyl)thio]acetate IUPAC Name: 2-(1-tert-butylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-tert-butylbenzimidazol-2-yl)thio]acetate Formula: C13H15N2O2S- MolecularWeight: 263.3354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=CC=CC=C2N=C1SCC(=O)[O-]

Isomeric SMILES

CC(C)(C)N1C2=CC=CC=C2N=C1SCC(=O)[O-]

InChI

InChI=1S/C13H16N2O2S/c1-13(2,3)15-10-7-5-4-6-9(10)14-12(15)18-8-11(16)17/h4-7H,8H2,1-3H3,(H,16,17)/p-1