1-butyl-N,N-dimethyl-2-(2-pyridin-4-ylethylsulfanyl)benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-N,N-dimethyl-2-(2-pyridin-4-ylethylsulfanyl)benzimidazole-5-sulfonamide Openeye Name: 1-butyl-N,N-dimethyl-2-[2-(4-pyridyl)ethylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-N,N-dimethyl-2-(2-pyridin-4-ylethylthio)-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-N,N-dimethyl-2-(2-pyridin-4-ylethylsulfanyl)benzimidazole-5-sulfonamide Traditional Name: 1-butyl-N,N-dimethyl-2-[2-(4-pyridyl)ethylthio]benzimidazole-5-sulfonamide Formula: C20H26N4O2S2 MolecularWeight: 418.57604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCCC3=CC=NC=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCCC3=CC=NC=C3

InChI

InChI=1S/C20H26N4O2S2/c1-4-5-13-24-19-7-6-17(28(25,26)23(2)3)15-18(19)22-20(24)27-14-10-16-8-11-21-12-9-16/h6-9,11-12,15H,4-5,10,13-14H2,1-3H3