2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanyl-N-(4-methyl-3-sulfamoyl-phenyl)ethanamide

Systemtic Name: 2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanyl-N-(4-methyl-3-sulfamoyl-phenyl)ethanamide Openeye Name: 2-(1-isopentylbenzimidazol-2-yl)sulfanyl-N-(4-methyl-3-sulfamoyl-phenyl)acetamide CAS Name: 2-[[1-(3-methylbutyl)-2-benzimidazolyl]thio]-N-(4-methyl-3-sulfamoylphenyl)acetamide IUPAC Name: 2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanyl-N-(4-methyl-3-sulfamoylphenyl)acetamide Traditional Name: 2-[(1-isoamylbenzimidazol-2-yl)thio]-N-(4-methyl-3-sulfamoyl-phenyl)acetamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CCC(C)C)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CCC(C)C)S(=O)(=O)N

InChI

InChI=1S/C21H26N4O3S2/c1-14(2)10-11-25-18-7-5-4-6-17(18)24-21(25)29-13-20(26)23-16-9-8-15(3)19(12-16)30(22,27)28/h4-9,12,14H,10-11,13H2,1-3H3,(H,23,26)(H2,22,27,28)