2-[(4-bromanyl-5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(4-bromanyl-5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]ethanoate Openeye Name: 2-[(4-bromo-5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]acetate CAS Name: 2-[(4-bromo-5,6-dimethyl-1H-benzimidazol-2-yl)thio]acetate IUPAC Name: 2-[(4-bromo-5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-bromo-5,6-dimethyl-1H-benzimidazol-2-yl)thio]acetate Formula: C11H10BrN2O2S- MolecularWeight: 314.1783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C)Br)N=C(N2)SCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C1C)Br)N=C(N2)SCC(=O)[O-]

InChI

InChI=1S/C11H11BrN2O2S/c1-5-3-7-10(9(12)6(5)2)14-11(13-7)17-4-8(15)16/h3H,4H2,1-2H3,(H,13,14)(H,15,16)/p-1