N-(2-tert-butylsulfanylethyl)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-(N-methylsulfonyl-4-phenoxy-anilino)acetamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(N-mesyl-4-phenoxy-anilino)acetamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNC(=O)CN(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)SCCNC(=O)CN(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O4S2/c1-21(2,3)28-15-14-22-20(24)16-23(29(4,25)26)17-10-12-19(13-11-17)27-18-8-6-5-7-9-18/h5-13H,14-16H2,1-4H3,(H,22,24)