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

Systemtic Name: N-[3-(4-methylphenyl)sulfanylpropyl]-2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanamide Openeye Name: 2-(N-methylsulfonyl-2-phenoxy-anilino)-N-[3-(p-tolylsulfanyl)propyl]acetamide CAS Name: N-[3-[(4-methylphenyl)thio]propyl]-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide IUPAC Name: N-[3-(4-methylphenyl)sulfanylpropyl]-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide Traditional Name: 2-(N-mesyl-2-phenoxy-anilino)-N-[3-(p-tolylthio)propyl]acetamide Formula: C25H28N2O4S2 MolecularWeight: 484.63082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O4S2/c1-20-13-15-22(16-14-20)32-18-8-17-26-25(28)19-27(33(2,29)30)23-11-6-7-12-24(23)31-21-9-4-3-5-10-21/h3-7,9-16H,8,17-19H2,1-2H3,(H,26,28)