1-butyl-2-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[3-(dimethylsulfamoyl)phenyl]methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[3-(dimethylsulfamoyl)benzyl]thio]benzimidazole-5-sulfonamide Formula: C20H26N4O4S3 MolecularWeight: 482.63984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H26N4O4S3/c1-4-5-11-24-19-10-9-16(30(21,25)26)13-18(19)22-20(24)29-14-15-7-6-8-17(12-15)31(27,28)23(2)3/h6-10,12-13H,4-5,11,14H2,1-3H3,(H2,21,25,26)