(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 1H-indazole-3-carboxylate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 1H-indazole-3-carboxylate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C20H21N5O4S/c1-2-3-10-25-17-9-8-13(30(21,27)28)11-16(17)22-18(25)12-29-20(26)19-14-6-4-5-7-15(14)23-24-19/h4-9,11H,2-3,10,12H2,1H3,(H,23,24)(H2,21,27,28)