N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]azepane-1-sulfonamide

Systemtic Name: N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]azepane-1-sulfonamide Openeye Name: N-[[2-(isopropylsulfamoylmethyl)phenyl]methyl]azepane-1-sulfonamide CAS Name: N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-1-azepanesulfonamide IUPAC Name: N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]azepane-1-sulfonamide Traditional Name: N-[2-(isopropylsulfamoylmethyl)benzyl]azepane-1-sulfonamide Formula: C17H29N3O4S2 MolecularWeight: 403.55986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNS(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNS(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C17H29N3O4S2/c1-15(2)19-25(21,22)14-17-10-6-5-9-16(17)13-18-26(23,24)20-11-7-3-4-8-12-20/h5-6,9-10,15,18-19H,3-4,7-8,11-14H2,1-2H3