2-[5-chloranyl-1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[5-chloranyl-1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-(5-chloro-1-isobutyl-benzimidazol-2-yl)sulfanylacetic acid CAS Name: 2-[[5-chloro-1-(2-methylpropyl)-2-benzimidazolyl]thio]acetic acid IUPAC Name: 2-[5-chloro-1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[(5-chloro-1-isobutyl-benzimidazol-2-yl)thio]acetic acid Formula: C13H15ClN2O2S MolecularWeight: 298.7884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)O

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)O

InChI

InChI=1S/C13H15ClN2O2S/c1-8(2)6-16-11-4-3-9(14)5-10(11)15-13(16)19-7-12(17)18/h3-5,8H,6-7H2,1-2H3,(H,17,18)