2-(2-octylsulfanylbenzimidazol-1-yl)ethanoic acid

Systemtic Name: 2-(2-octylsulfanylbenzimidazol-1-yl)ethanoic acid Openeye Name: 2-(2-octylsulfanylbenzimidazol-1-yl)acetic acid CAS Name: 2-[2-(octylthio)-1-benzimidazolyl]acetic acid IUPAC Name: 2-(2-octylsulfanylbenzimidazol-1-yl)acetic acid Traditional Name: 2-[2-(octylthio)benzimidazol-1-yl]acetic acid Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC2=CC=CC=C2N1CC(=O)O

Isomeric SMILES

CCCCCCCCSC1=NC2=CC=CC=C2N1CC(=O)O

InChI

InChI=1S/C17H24N2O2S/c1-2-3-4-5-6-9-12-22-17-18-14-10-7-8-11-15(14)19(17)13-16(20)21/h7-8,10-11H,2-6,9,12-13H2,1H3,(H,20,21)