N-(3-methylsulfanylphenyl)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide Openeye Name: N-(3-methylsulfanylphenyl)-2-(N-methylsulfonyl-4-phenoxy-anilino)acetamide CAS Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-[3-(methylthio)phenyl]acetamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-[3-(methylthio)phenyl]acetamide Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H22N2O4S2/c1-29-21-10-6-7-17(15-21)23-22(25)16-24(30(2,26)27)18-11-13-20(14-12-18)28-19-8-4-3-5-9-19/h3-15H,16H2,1-2H3,(H,23,25)