N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-[(3-methoxyphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-[(3-methoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-(3-methoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-2-(3-methoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-(3-methoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-2-(N-mesyl-3-methoxy-anilino)acetamide Formula: C19H23ClN2O4S2 MolecularWeight: 442.97992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CC(=O)NCCSCC2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)N(CC(=O)NCCSCC2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H23ClN2O4S2/c1-26-18-5-3-4-17(12-18)22(28(2,24)25)13-19(23)21-10-11-27-14-15-6-8-16(20)9-7-15/h3-9,12H,10-11,13-14H2,1-2H3,(H,21,23)