2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-(benzenesulfonyl)-2-benzimidazolyl]thio]acetic acid IUPAC Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[(1-besylbenzimidazol-2-yl)thio]acetic acid Formula: C15H12N2O4S2 MolecularWeight: 348.39678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3N=C2SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3N=C2SCC(=O)O

InChI

InChI=1S/C15H12N2O4S2/c18-14(19)10-22-15-16-12-8-4-5-9-13(12)17(15)23(20,21)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19)