(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl adamantane-1-carboxylate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl adamantane-1-carboxylate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H31N3O4S/c1-2-3-6-26-20-5-4-18(31(24,28)29)10-19(20)25-21(26)14-30-22(27)23-11-15-7-16(12-23)9-17(8-15)13-23/h4-5,10,15-17H,2-3,6-9,11-14H2,1H3,(H2,24,28,29)