N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanamide

Systemtic Name: N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanamide Openeye Name: 2-(N-methylsulfonyl-2-phenoxy-anilino)-N-[3-(m-tolylmethylsulfanyl)propyl]acetamide CAS Name: N-[3-[(3-methylphenyl)methylthio]propyl]-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide IUPAC Name: N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide Traditional Name: 2-(N-mesyl-2-phenoxy-anilino)-N-[3-[(3-methylbenzyl)thio]propyl]acetamide Formula: C26H30N2O4S2 MolecularWeight: 498.6574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCCNC(=O)CN(C2=CC=CC=C2OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CSCCCNC(=O)CN(C2=CC=CC=C2OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C26H30N2O4S2/c1-21-10-8-11-22(18-21)20-33-17-9-16-27-26(29)19-28(34(2,30)31)24-14-6-7-15-25(24)32-23-12-4-3-5-13-23/h3-8,10-15,18H,9,16-17,19-20H2,1-2H3,(H,27,29)