2-[(4-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(tetrahydrofuran-2-ylmethyl)benzimidazole-5-sulfonamide CAS Name: 2-[(4-bromophenyl)methylthio]-N,N-diethyl-1-(2-oxolanylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide Traditional Name: 2-[(4-bromobenzyl)thio]-N,N-diethyl-1-(tetrahydrofurfuryl)benzimidazole-5-sulfonamide Formula: C23H28BrN3O3S2 MolecularWeight: 538.52072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28BrN3O3S2/c1-3-26(4-2)32(28,29)20-11-12-22-21(14-20)25-23(27(22)15-19-6-5-13-30-19)31-16-17-7-9-18(24)10-8-17/h7-12,14,19H,3-6,13,15-16H2,1-2H3