2-[1-(4-methylpentan-2-yl)benzimidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(4-methylpentan-2-yl)benzimidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-(1,3-dimethylbutyl)benzimidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-(4-methylpentan-2-yl)-2-benzimidazolyl]thio]acetic acid IUPAC Name: 2-[1-(4-methylpentan-2-yl)benzimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[1-(1,3-dimethylbutyl)benzimidazol-2-yl]thio]acetic acid Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)N1C2=CC=CC=C2N=C1SCC(=O)O

Isomeric SMILES

CC(C)CC(C)N1C2=CC=CC=C2N=C1SCC(=O)O

InChI

InChI=1S/C15H20N2O2S/c1-10(2)8-11(3)17-13-7-5-4-6-12(13)16-15(17)20-9-14(18)19/h4-7,10-11H,8-9H2,1-3H3,(H,18,19)