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

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(4-methylphenoxy)propanoate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(4-methylphenoxy)propanoate CAS Name: 3-(4-methylphenoxy)propanoic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 3-(4-methylphenoxy)propanoate Traditional Name: 3-(4-methylphenoxy)propionic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCOC3=CC=C(C=C3)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCOC3=CC=C(C=C3)C

InChI

InChI=1S/C23H29N3O5S/c1-5-13-26-21-11-10-19(32(28,29)25(3)4)15-20(21)24-22(26)16-31-23(27)12-14-30-18-8-6-17(2)7-9-18/h6-11,15H,5,12-14,16H2,1-4H3