(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-(2,5-dimethylphenyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethylphenyl)-4-oxobutanoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 4-(2,5-dimethylphenyl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethylphenyl)-4-keto-butyric acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C24H29N3O5S MolecularWeight: 471.56916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CCC(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CCC(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C24H29N3O5S/c1-4-5-12-27-21-9-8-18(33(25,30)31)14-20(21)26-23(27)15-32-24(29)11-10-22(28)19-13-16(2)6-7-17(19)3/h6-9,13-14H,4-5,10-12,15H2,1-3H3,(H2,25,30,31)