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

Systemtic Name: 2-(2-propylsulfanylbenzimidazol-1-yl)ethanoic acid Openeye Name: 2-(2-propylsulfanylbenzimidazol-1-yl)acetic acid CAS Name: 2-[2-(propylthio)-1-benzimidazolyl]acetic acid IUPAC Name: 2-(2-propylsulfanylbenzimidazol-1-yl)acetic acid Traditional Name: 2-[2-(propylthio)benzimidazol-1-yl]acetic acid Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=CC=CC=C2N1CC(=O)O

Isomeric SMILES

CCCSC1=NC2=CC=CC=C2N1CC(=O)O

InChI

InChI=1S/C12H14N2O2S/c1-2-7-17-12-13-9-5-3-4-6-10(9)14(12)8-11(15)16/h3-6H,2,7-8H2,1H3,(H,15,16)