N-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]-N-methyl-azepane-1-sulfonamide

Systemtic Name: N-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]-N-methyl-azepane-1-sulfonamide Openeye Name: N-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]-N-methyl-azepane-1-sulfonamide CAS Name: N-[2-tert-butyl-1-(4-oxanylmethyl)-5-benzimidazolyl]-N-methyl-1-azepanesulfonamide IUPAC Name: N-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]-N-methylazepane-1-sulfonamide Traditional Name: N-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]-N-methyl-azepane-1-sulfonamide Formula: C24H38N4O3S MolecularWeight: 462.64852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)N(C)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)N(C)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H38N4O3S/c1-24(2,3)23-25-21-17-20(26(4)32(29,30)27-13-7-5-6-8-14-27)9-10-22(21)28(23)18-19-11-15-31-16-12-19/h9-10,17,19H,5-8,11-16,18H2,1-4H3