4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-N-cyclohexyl-N-methyl-benzenesulfonamide

Systemtic Name: 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-N-cyclohexyl-N-methyl-benzenesulfonamide Openeye Name: 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-N-cyclohexyl-N-methyl-benzenesulfonamide CAS Name: 4-[2-(1H-benzimidazol-2-ylthio)ethyl]-N-cyclohexyl-N-methylbenzenesulfonamide IUPAC Name: 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-N-cyclohexyl-N-methylbenzenesulfonamide Traditional Name: 4-[2-(1H-benzimidazol-2-ylthio)ethyl]-N-cyclohexyl-N-methyl-benzenesulfonamide Formula: C22H27N3O2S2 MolecularWeight: 429.59868

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)CCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)CCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H27N3O2S2/c1-25(18-7-3-2-4-8-18)29(26,27)19-13-11-17(12-14-19)15-16-28-22-23-20-9-5-6-10-21(20)24-22/h5-6,9-14,18H,2-4,7-8,15-16H2,1H3,(H,23,24)