4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[[methyl-[(2S)-2-oxidanylpropyl]amino]methyl]benzenesulfonamide

Systemtic Name: 4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[[methyl-[(2S)-2-oxidanylpropyl]amino]methyl]benzenesulfonamide Openeye Name: 3-[[[(2S)-2-hydroxypropyl]-methyl-amino]methyl]-4-(3-methyl-4-methylsulfanyl-phenoxy)benzenesulfonamide CAS Name: 3-[[[(2S)-2-hydroxypropyl]-methylamino]methyl]-4-[3-methyl-4-(methylthio)phenoxy]benzenesulfonamide IUPAC Name: 3-[[[(2S)-2-hydroxypropyl]-methylamino]methyl]-4-(3-methyl-4-methylsulfanylphenoxy)benzenesulfonamide Traditional Name: 3-[[[(2S)-2-hydroxypropyl]-methyl-amino]methyl]-4-[3-methyl-4-(methylthio)phenoxy]benzenesulfonamide Formula: C19H26N2O4S2 MolecularWeight: 410.55074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N)CN(C)CC(C)O)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N)CN(C)C[C@H](C)O)SC

InChI

InChI=1S/C19H26N2O4S2/c1-13-9-16(5-8-19(13)26-4)25-18-7-6-17(27(20,23)24)10-15(18)12-21(3)11-14(2)22/h5-10,14,22H,11-12H2,1-4H3,(H2,20,23,24)/t14-/m0/s1