3-[4-[(5-methoxy-2-sulfanylidene-3H-benzimidazol-1-yl)sulfonyl]phenoxy]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[4-[(5-methoxy-2-sulfanylidene-3H-benzimidazol-1-yl)sulfonyl]phenoxy]-2,2-dimethyl-propanoic acid Openeye Name: 3-[4-[(5-methoxy-2-thioxo-3H-benzimidazol-1-yl)sulfonyl]phenoxy]-2,2-dimethyl-propanoic acid CAS Name: 3-[4-[(5-methoxy-2-sulfanylidene-3H-benzimidazol-1-yl)sulfonyl]phenoxy]-2,2-dimethylpropanoic acid IUPAC Name: 3-[4-[(5-methoxy-2-sulfanylidene-3H-benzimidazol-1-yl)sulfonyl]phenoxy]-2,2-dimethylpropanoic acid Traditional Name: 3-[4-[(5-methoxy-2-thioxo-3H-benzimidazol-1-yl)sulfonyl]phenoxy]-2,2-dimethyl-propionic acid Formula: C19H20N2O6S2 MolecularWeight: 436.5019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)OC)NC2=S)C(=O)O

Isomeric SMILES

CC(C)(COC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)OC)NC2=S)C(=O)O

InChI

InChI=1S/C19H20N2O6S2/c1-19(2,17(22)23)11-27-12-4-7-14(8-5-12)29(24,25)21-16-9-6-13(26-3)10-15(16)20-18(21)28/h4-10H,11H2,1-3H3,(H,20,28)(H,22,23)