2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methylthio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[4-(2-cyanophenyl)benzyl]thio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C23H20N4O2S2 MolecularWeight: 448.5605

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H20N4O2S2/c1-2-27-22-12-11-19(31(25,28)29)13-21(22)26-23(27)30-15-16-7-9-17(10-8-16)20-6-4-3-5-18(20)14-24/h3-13H,2,15H2,1H3,(H2,25,28,29)