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

Systemtic Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-(3,4-dimethyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-[(2-chlorophenyl)methylthio]ethyl]-2-(3,4-dimethyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-(3,4-dimethyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-[(2-chlorobenzyl)thio]ethyl]-2-(N-mesyl-3,4-dimethyl-anilino)acetamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCCSCC2=CC=CC=C2Cl)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCCSCC2=CC=CC=C2Cl)S(=O)(=O)C)C

InChI

InChI=1S/C20H25ClN2O3S2/c1-15-8-9-18(12-16(15)2)23(28(3,25)26)13-20(24)22-10-11-27-14-17-6-4-5-7-19(17)21/h4-9,12H,10-11,13-14H2,1-3H3,(H,22,24)