2-[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenoxy]-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenoxy]-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-[4-[methylsulfonyl(p-tolylmethyl)amino]phenoxy]-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-[4-[(4-methylphenyl)methyl-methylsulfonylamino]phenoxy]-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-[4-[(4-methylphenyl)methyl-methylsulfonylamino]phenoxy]-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-[4-[mesyl-(4-methylbenzyl)amino]phenoxy]-N-[2-(phenylthio)phenyl]acetamide Formula: C29H28N2O4S2 MolecularWeight: 532.67362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C29H28N2O4S2/c1-22-12-14-23(15-13-22)20-31(37(2,33)34)24-16-18-25(19-17-24)35-21-29(32)30-27-10-6-7-11-28(27)36-26-8-4-3-5-9-26/h3-19H,20-21H2,1-2H3,(H,30,32)