2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(2,5-dimethyl-N-methylsulfonyl-anilino)acetamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(2,5-dimethyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(N-mesyl-2,5-dimethyl-anilino)acetamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O3S2/c1-16-9-10-17(2)19(13-16)22(27(3,24)25)14-20(23)21-11-12-26-15-18-7-5-4-6-8-18/h4-10,13H,11-12,14-15H2,1-3H3,(H,21,23)