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

Systemtic Name: 1-butyl-2-[(3-cyanophenyl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(3-cyanophenyl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(3-cyanophenyl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[(3-cyanophenyl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(3-cyanobenzyl)thio]benzimidazole-5-sulfonamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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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)C#N

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O2S2/c1-2-3-9-23-18-8-7-16(27(21,24)25)11-17(18)22-19(23)26-13-15-6-4-5-14(10-15)12-20/h4-8,10-11H,2-3,9,13H2,1H3,(H2,21,24,25)