(E)-2-[3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]ethenesulfonamide

Systemtic Name: (E)-2-[3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]ethenesulfonamide Openeye Name: (E)-2-[3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]ethenesulfonamide CAS Name: (E)-2-[3-(dimethylaminomethyl)-4-[4-(methylthio)phenoxy]phenyl]ethenesulfonamide IUPAC Name: (E)-2-[3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]ethenesulfonamide Traditional Name: (E)-2-[3-(dimethylaminomethyl)-4-[4-(methylthio)phenoxy]phenyl]ethenesulfonamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3S2/c1-20(2)13-15-12-14(10-11-25(19,21)22)4-9-18(15)23-16-5-7-17(24-3)8-6-16/h4-12H,13H2,1-3H3,(H2,19,21,22)/b11-10+