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

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 1H-indole-2-carboxylate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 1H-indole-2-carboxylate CAS Name: 1H-indole-2-carboxylic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 1H-indole-2-carboxylate Traditional Name: 1H-indole-2-carboxylic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O4S/c1-2-3-10-25-19-9-8-15(30(22,27)28)12-17(19)24-20(25)13-29-21(26)18-11-14-6-4-5-7-16(14)23-18/h4-9,11-12,23H,2-3,10,13H2,1H3,(H2,22,27,28)