N-[2-(4-methylphenyl)sulfanylethyl]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanamide Openeye Name: 2-(N-methylsulfonyl-4-phenoxy-anilino)-N-[2-(p-tolylsulfanyl)ethyl]propanamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2-(N-methylsulfonyl-4-phenoxyanilino)propanamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(N-methylsulfonyl-4-phenoxyanilino)propanamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-[2-(p-tolylthio)ethyl]propionamide Formula: C25H28N2O4S2 MolecularWeight: 484.63082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C(C)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C(C)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H28N2O4S2/c1-19-9-15-24(16-10-19)32-18-17-26-25(28)20(2)27(33(3,29)30)21-11-13-23(14-12-21)31-22-7-5-4-6-8-22/h4-16,20H,17-18H2,1-3H3,(H,26,28)