5-(5-chloranylthiophen-2-yl)-6-(2-hydroxyethylsulfonyl)-1-(1,2-oxazol-3-ylmethyl)benzimidazole-2-carboxylic acid

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-6-(2-hydroxyethylsulfonyl)-1-(1,2-oxazol-3-ylmethyl)benzimidazole-2-carboxylic acid Openeye Name: 5-(5-chloro-2-thienyl)-6-(2-hydroxyethylsulfonyl)-1-(isoxazol-3-ylmethyl)benzimidazole-2-carboxylic acid CAS Name: 5-(5-chloro-2-thiophenyl)-6-(2-hydroxyethylsulfonyl)-1-(3-isoxazolylmethyl)-2-benzimidazolecarboxylic acid IUPAC Name: 5-(5-chlorothiophen-2-yl)-6-(2-hydroxyethylsulfonyl)-1-(1,2-oxazol-3-ylmethyl)benzimidazole-2-carboxylic acid Traditional Name: 5-(5-chloro-2-thienyl)-6-(2-hydroxyethylsulfonyl)-1-(isoxazol-3-ylmethyl)benzimidazole-2-carboxylic acid Formula: C18H14ClN3O6S2 MolecularWeight: 467.90326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CON=C1CN2C3=C(C=C(C(=C3)S(=O)(=O)CCO)C4=CC=C(S4)Cl)N=C2C(=O)O

Isomeric SMILES

C1=CON=C1CN2C3=C(C=C(C(=C3)S(=O)(=O)CCO)C4=CC=C(S4)Cl)N=C2C(=O)O

InChI

InChI=1S/C18H14ClN3O6S2/c19-16-2-1-14(29-16)11-7-12-13(8-15(11)30(26,27)6-4-23)22(17(20-12)18(24)25)9-10-3-5-28-21-10/h1-3,5,7-8,23H,4,6,9H2,(H,24,25)