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

Systemtic Name: N-[3-[(3-chlorophenyl)methylsulfanyl]propyl]-2-[(4-methoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-[(3-chlorophenyl)methylsulfanyl]propyl]-2-(4-methoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-[(3-chlorophenyl)methylthio]propyl]-2-(4-methoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-[(3-chlorophenyl)methylsulfanyl]propyl]-2-(4-methoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-[(3-chlorobenzyl)thio]propyl]-2-(N-mesyl-4-methoxy-anilino)acetamide Formula: C20H25ClN2O4S2 MolecularWeight: 457.0065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C20H25ClN2O4S2/c1-27-19-9-7-18(8-10-19)23(29(2,25)26)14-20(24)22-11-4-12-28-15-16-5-3-6-17(21)13-16/h3,5-10,13H,4,11-12,14-15H2,1-2H3,(H,22,24)