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

Systemtic Name: 2-[(3-ethoxyphenyl)-methylsulfonyl-amino]-N-[3-[(3-methylphenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-(3-ethoxy-N-methylsulfonyl-anilino)-N-[3-(m-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-(3-ethoxy-N-methylsulfonylanilino)-N-[3-[(3-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-(3-ethoxy-N-methylsulfonylanilino)-N-[3-[(3-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(3-ethoxy-N-mesyl-anilino)-N-[3-[(3-methylbenzyl)thio]propyl]acetamide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N(CC(=O)NCCCSCC2=CC=CC(=C2)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)N(CC(=O)NCCCSCC2=CC=CC(=C2)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O4S2/c1-4-28-21-11-6-10-20(15-21)24(30(3,26)27)16-22(25)23-12-7-13-29-17-19-9-5-8-18(2)14-19/h5-6,8-11,14-15H,4,7,12-13,16-17H2,1-3H3,(H,23,25)