N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-2-[(3-ethoxyphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-2-[(3-ethoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-2-(3-ethoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-[(3-chlorophenyl)methylthio]ethyl]-2-(3-ethoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-2-(3-ethoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-[(3-chlorobenzyl)thio]ethyl]-2-(3-ethoxy-N-mesyl-anilino)acetamide Formula: C20H25ClN2O4S2 MolecularWeight: 457.0065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N(CC(=O)NCCSCC2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)N(CC(=O)NCCSCC2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C20H25ClN2O4S2/c1-3-27-19-9-5-8-18(13-19)23(29(2,25)26)14-20(24)22-10-11-28-15-16-6-4-7-17(21)12-16/h4-9,12-13H,3,10-11,14-15H2,1-2H3,(H,22,24)