N-[3-(4-chlorophenyl)sulfanylpropyl]-2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfanylpropyl]-2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanamide Openeye Name: N-[3-(4-chlorophenyl)sulfanylpropyl]-2-(N-methylsulfonyl-4-propoxy-anilino)acetamide CAS Name: N-[3-[(4-chlorophenyl)thio]propyl]-2-(N-methylsulfonyl-4-propoxyanilino)acetamide IUPAC Name: N-[3-(4-chlorophenyl)sulfanylpropyl]-2-(N-methylsulfonyl-4-propoxyanilino)acetamide Traditional Name: N-[3-[(4-chlorophenyl)thio]propyl]-2-(N-mesyl-4-propoxy-anilino)acetamide Formula: C21H27ClN2O4S2 MolecularWeight: 471.03308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N(CC(=O)NCCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N(CC(=O)NCCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O4S2/c1-3-14-28-19-9-7-18(8-10-19)24(30(2,26)27)16-21(25)23-13-4-15-29-20-11-5-17(22)6-12-20/h5-12H,3-4,13-16H2,1-2H3,(H,23,25)