N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanamide

Systemtic Name: N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanamide Openeye Name: 2-(N-methylsulfonyl-4-propoxy-anilino)-N-[3-(m-tolylmethylsulfanyl)propyl]acetamide CAS Name: N-[3-[(3-methylphenyl)methylthio]propyl]-2-(N-methylsulfonyl-4-propoxyanilino)acetamide IUPAC Name: N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-(N-methylsulfonyl-4-propoxyanilino)acetamide Traditional Name: 2-(N-mesyl-4-propoxy-anilino)-N-[3-[(3-methylbenzyl)thio]propyl]acetamide Formula: C23H32N2O4S2 MolecularWeight: 464.64118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC=CC(=C2)C)S(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC=CC(=C2)C)S(=O)(=O)C

InChI

InChI=1S/C23H32N2O4S2/c1-4-14-29-22-11-9-21(10-12-22)25(31(3,27)28)17-23(26)24-13-6-15-30-18-20-8-5-7-19(2)16-20/h5,7-12,16H,4,6,13-15,17-18H2,1-3H3,(H,24,26)