3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)-N-[(2R)-2-oxidanylpropyl]benzenesulfonamide

Systemtic Name: 3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)-N-[(2R)-2-oxidanylpropyl]benzenesulfonamide Openeye Name: 3-(dimethylaminomethyl)-N-[(2R)-2-hydroxypropyl]-4-(4-methylsulfanylphenoxy)benzenesulfonamide CAS Name: 3-(dimethylaminomethyl)-N-[(2R)-2-hydroxypropyl]-4-[4-(methylthio)phenoxy]benzenesulfonamide IUPAC Name: 3-(dimethylaminomethyl)-N-[(2R)-2-hydroxypropyl]-4-(4-methylsulfanylphenoxy)benzenesulfonamide Traditional Name: 3-(dimethylaminomethyl)-N-[(2R)-2-hydroxypropyl]-4-[4-(methylthio)phenoxy]benzenesulfonamide Formula: C19H26N2O4S2 MolecularWeight: 410.55074

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)SC)CN(C)C)O

Isomeric SMILES

C[C@H](CNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)SC)CN(C)C)O

InChI

InChI=1S/C19H26N2O4S2/c1-14(22)12-20-27(23,24)18-9-10-19(15(11-18)13-21(2)3)25-16-5-7-17(26-4)8-6-16/h5-11,14,20,22H,12-13H2,1-4H3/t14-/m1/s1