N-[3-(aminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]-N-(2-hydroxyethyl)methanesulfonamide

Systemtic Name: N-[3-(aminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]-N-(2-hydroxyethyl)methanesulfonamide Openeye Name: N-[3-(aminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]-N-(2-hydroxyethyl)methanesulfonamide CAS Name: N-[3-(aminomethyl)-4-[4-(methylthio)phenoxy]phenyl]-N-(2-hydroxyethyl)methanesulfonamide IUPAC Name: N-[3-(aminomethyl)-4-(4-methylsulfanylphenoxy)phenyl]-N-(2-hydroxyethyl)methanesulfonamide Traditional Name: N-[3-(aminomethyl)-4-[4-(methylthio)phenoxy]phenyl]-N-(2-hydroxyethyl)methanesulfonamide Formula: C17H22N2O4S2 MolecularWeight: 382.49758

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC2=C(C=C(C=C2)N(CCO)S(=O)(=O)C)CN

Isomeric SMILES

CSC1=CC=C(C=C1)OC2=C(C=C(C=C2)N(CCO)S(=O)(=O)C)CN

InChI

InChI=1S/C17H22N2O4S2/c1-24-16-6-4-15(5-7-16)23-17-8-3-14(11-13(17)12-18)19(9-10-20)25(2,21)22/h3-8,11,20H,9-10,12,18H2,1-2H3