[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl adamantane-1-carboxylate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl adamantane-1-carboxylate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C24H33N3O4S MolecularWeight: 459.60152

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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)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H33N3O4S/c1-4-7-27-21-6-5-19(32(29,30)26(2)3)11-20(21)25-22(27)15-31-23(28)24-12-16-8-17(13-24)10-18(9-16)14-24/h5-6,11,16-18H,4,7-10,12-15H2,1-3H3