[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C24H31N3O6S MolecularWeight: 489.58444

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H31N3O6S/c1-6-13-27-20-10-9-18(34(29,30)26(2)3)15-19(20)25-23(27)16-33-24(28)12-8-17-7-11-21(31-4)22(14-17)32-5/h7,9-11,14-15H,6,8,12-13,16H2,1-5H3