[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 3-(2,5-dimethylphenoxy)propanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 3-(2,5-dimethylphenoxy)propanoate Openeye Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 3-(2,5-dimethylphenoxy)propanoate CAS Name: 3-(2,5-dimethylphenoxy)propanoic acid [5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl 3-(2,5-dimethylphenoxy)propanoate Traditional Name: 3-(2,5-dimethylphenoxy)propionic acid [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCOC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCOC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H29N3O5S/c1-6-26-20-10-9-18(32(28,29)25(4)5)14-19(20)24-22(26)15-31-23(27)11-12-30-21-13-16(2)7-8-17(21)3/h7-10,13-14H,6,11-12,15H2,1-5H3