2-[(2-cyanophenyl)methylsulfanyl]-N,N,1-triethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(2-cyanophenyl)methylsulfanyl]-N,N,1-triethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(2-cyanophenyl)methylsulfanyl]-N,N,1-triethyl-benzimidazole-5-sulfonamide CAS Name: 2-[(2-cyanophenyl)methylthio]-N,N,1-triethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(2-cyanophenyl)methylsulfanyl]-N,N,1-triethylbenzimidazole-5-sulfonamide Traditional Name: 2-[(2-cyanobenzyl)thio]-N,N,1-triethyl-benzimidazole-5-sulfonamide Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=CC=CC=C3C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=CC=CC=C3C#N

InChI

InChI=1S/C21H24N4O2S2/c1-4-24(5-2)29(26,27)18-11-12-20-19(13-18)23-21(25(20)6-3)28-15-17-10-8-7-9-16(17)14-22/h7-13H,4-6,15H2,1-3H3