N-[5-[1-methylsulfanyl-2-(propan-2-ylamino)ethyl]-2-oxidanyl-phenyl]methanesulfonamide

Systemtic Name: N-[5-[1-methylsulfanyl-2-(propan-2-ylamino)ethyl]-2-oxidanyl-phenyl]methanesulfonamide Openeye Name: N-[2-hydroxy-5-[2-(isopropylamino)-1-methylsulfanyl-ethyl]phenyl]methanesulfonamide CAS Name: N-[2-hydroxy-5-[1-(methylthio)-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide IUPAC Name: N-[2-hydroxy-5-[1-methylsulfanyl-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide Traditional Name: N-[2-hydroxy-5-[2-(isopropylamino)-1-(methylthio)ethyl]phenyl]methanesulfonamide Formula: C13H22N2O3S2 MolecularWeight: 318.45538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C1=CC(=C(C=C1)O)NS(=O)(=O)C)SC

Isomeric SMILES

CC(C)NCC(C1=CC(=C(C=C1)O)NS(=O)(=O)C)SC

InChI

InChI=1S/C13H22N2O3S2/c1-9(2)14-8-13(19-3)10-5-6-12(16)11(7-10)15-20(4,17)18/h5-7,9,13-16H,8H2,1-4H3