2-[(2,5-dimethylphenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-N,N-diethyl-1-(tetrahydrofuran-2-ylmethyl)benzimidazole-5-sulfonamide CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-N,N-diethyl-1-(2-oxolanylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-N,N-diethyl-1-(tetrahydrofurfuryl)benzimidazole-5-sulfonamide Formula: C25H33N3O3S2 MolecularWeight: 487.67782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C(C=CC(=C3)C)C)CC4CCCO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C(C=CC(=C3)C)C)CC4CCCO4

InChI

InChI=1S/C25H33N3O3S2/c1-5-27(6-2)33(29,30)22-11-12-24-23(15-22)26-25(28(24)16-21-8-7-13-31-21)32-17-20-14-18(3)9-10-19(20)4/h9-12,14-15,21H,5-8,13,16-17H2,1-4H3