(4-cyano-2-methoxy-phenyl) 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanoate Openeye Name: (4-cyano-2-methoxy-phenyl) 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanoate CAS Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]propanoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanoate Traditional Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propionic acid (4-cyano-2-methoxy-phenyl) ester Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)OC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)OC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C22H24N4O5S/c1-5-26-18-8-7-16(32(28,29)25(2)3)13-17(18)24-21(26)10-11-22(27)31-19-9-6-15(14-23)12-20(19)30-4/h6-9,12-13H,5,10-11H2,1-4H3