2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[2-(o-tolylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[2-[(2-methylphenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-[2-[(2-methylbenzyl)thio]ethyl]acetamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCCSCC2=CC=CC=C2C)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCCSCC2=CC=CC=C2C)S(=O)(=O)C)C

InChI

InChI=1S/C21H28N2O3S2/c1-16-9-10-20(13-18(16)3)23(28(4,25)26)14-21(24)22-11-12-27-15-19-8-6-5-7-17(19)2/h5-10,13H,11-12,14-15H2,1-4H3,(H,22,24)