1-ethyl-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[2-(4-methoxyphenyl)-1-azepanyl]methyl]-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCCCCC3C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCCCCC3C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H34N4O3S/c1-5-29-24-15-14-21(33(30,31)27(2)3)17-22(24)26-25(29)18-28-16-8-6-7-9-23(28)19-10-12-20(32-4)13-11-19/h10-15,17,23H,5-9,16,18H2,1-4H3