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

Systemtic Name: N-[3-[(2-chlorophenyl)methylsulfanyl]propyl]-2-[(2-ethoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-[(2-chlorophenyl)methylsulfanyl]propyl]-2-(2-ethoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-[(2-chlorophenyl)methylthio]propyl]-2-(2-ethoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-[(2-chlorophenyl)methylsulfanyl]propyl]-2-(2-ethoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-[(2-chlorobenzyl)thio]propyl]-2-(2-ethoxy-N-mesyl-anilino)acetamide Formula: C21H27ClN2O4S2 MolecularWeight: 471.03308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N(CC(=O)NCCCSCC2=CC=CC=C2Cl)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1N(CC(=O)NCCCSCC2=CC=CC=C2Cl)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O4S2/c1-3-28-20-12-7-6-11-19(20)24(30(2,26)27)15-21(25)23-13-8-14-29-16-17-9-4-5-10-18(17)22/h4-7,9-12H,3,8,13-16H2,1-2H3,(H,23,25)