4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[[methyl-[(2R)-oxolan-2-yl]amino]methyl]benzenesulfonamide

Systemtic Name: 4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[[methyl-[(2R)-oxolan-2-yl]amino]methyl]benzenesulfonamide Openeye Name: 4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[[methyl-[(2R)-tetrahydrofuran-2-yl]amino]methyl]benzenesulfonamide CAS Name: 4-[3-methyl-4-(methylthio)phenoxy]-3-[[methyl-[(2R)-2-oxolanyl]amino]methyl]benzenesulfonamide IUPAC Name: 4-(3-methyl-4-methylsulfanylphenoxy)-3-[[methyl-[(2R)-oxolan-2-yl]amino]methyl]benzenesulfonamide Traditional Name: 4-[3-methyl-4-(methylthio)phenoxy]-3-[[methyl-[(2R)-tetrahydrofuran-2-yl]amino]methyl]benzenesulfonamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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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)C3CCCO3)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N)CN(C)[C@H]3CCCO3)SC

InChI

InChI=1S/C20H26N2O4S2/c1-14-11-16(6-9-19(14)27-3)26-18-8-7-17(28(21,23)24)12-15(18)13-22(2)20-5-4-10-25-20/h6-9,11-12,20H,4-5,10,13H2,1-3H3,(H2,21,23,24)/t20-/m1/s1