[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl ester Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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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)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H26N4O4S2/c1-4-27-19-13-12-16(33(29,30)26(2)3)14-18(19)24-21(27)15-31-23(28)11-7-10-22-25-17-8-5-6-9-20(17)32-22/h5-6,8-9,12-14H,4,7,10-11,15H2,1-3H3