N-[3-(4-azanylbutyl)-2-(methylsulfonylamino)phenyl]methanesulfonamide

Systemtic Name: N-[3-(4-azanylbutyl)-2-(methylsulfonylamino)phenyl]methanesulfonamide Openeye Name: N-[3-(4-aminobutyl)-2-(methanesulfonamido)phenyl]methanesulfonamide CAS Name: N-[3-(4-aminobutyl)-2-(methanesulfonamido)phenyl]methanesulfonamide IUPAC Name: N-[3-(4-aminobutyl)-2-(methanesulfonamido)phenyl]methanesulfonamide Traditional Name: N-[3-(4-aminobutyl)-2-(methanesulfonamido)phenyl]methanesulfonamide Formula: C12H21N3O4S2 MolecularWeight: 335.44284

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1NS(=O)(=O)C)CCCCN

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1NS(=O)(=O)C)CCCCN

InChI

InChI=1S/C12H21N3O4S2/c1-20(16,17)14-11-8-5-7-10(6-3-4-9-13)12(11)15-21(2,18)19/h5,7-8,14-15H,3-4,6,9,13H2,1-2H3