2-(2,4-dicyanobutylsulfanyl)-N,N-diethyl-1-(4-methoxyphenyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-(2,4-dicyanobutylsulfanyl)-N,N-diethyl-1-(4-methoxyphenyl)benzimidazole-5-sulfonamide Openeye Name: 2-(2,4-dicyanobutylsulfanyl)-N,N-diethyl-1-(4-methoxyphenyl)benzimidazole-5-sulfonamide CAS Name: 2-(2,4-dicyanobutylthio)-N,N-diethyl-1-(4-methoxyphenyl)-5-benzimidazolesulfonamide IUPAC Name: 2-(2,4-dicyanobutylsulfanyl)-N,N-diethyl-1-(4-methoxyphenyl)benzimidazole-5-sulfonamide Traditional Name: 2-(2,4-dicyanobutylthio)-N,N-diethyl-1-(4-methoxyphenyl)benzimidazole-5-sulfonamide Formula: C24H27N5O3S2 MolecularWeight: 497.63288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(CCC#N)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(CCC#N)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H27N5O3S2/c1-4-28(5-2)34(30,31)21-12-13-23-22(15-21)27-24(33-17-18(16-26)7-6-14-25)29(23)19-8-10-20(32-3)11-9-19/h8-13,15,18H,4-7,17H2,1-3H3