4-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[[2-(azepan-1-yl)-2-oxo-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[[2-(1-azepanyl)-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[[2-(azepan-1-yl)-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[[2-(azepan-1-yl)-2-keto-ethyl]-mesyl-amino]-N,N-dimethyl-benzenesulfonamide Formula: C17H27N3O5S2 MolecularWeight: 417.54338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C

InChI

InChI=1S/C17H27N3O5S2/c1-18(2)27(24,25)16-10-8-15(9-11-16)20(26(3,22)23)14-17(21)19-12-6-4-5-7-13-19/h8-11H,4-7,12-14H2,1-3H3