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

Systemtic Name: N-[3-(4-methylphenyl)sulfanylpropyl]-2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanamide Openeye Name: 2-(4-benzyloxy-N-methylsulfonyl-anilino)-N-[3-(p-tolylsulfanyl)propyl]acetamide CAS Name: N-[3-[(4-methylphenyl)thio]propyl]-2-(N-methylsulfonyl-4-phenylmethoxyanilino)acetamide IUPAC Name: N-[3-(4-methylphenyl)sulfanylpropyl]-2-(N-methylsulfonyl-4-phenylmethoxyanilino)acetamide Traditional Name: 2-(4-benzoxy-N-mesyl-anilino)-N-[3-(p-tolylthio)propyl]acetamide Formula: C26H30N2O4S2 MolecularWeight: 498.6574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCNC(=O)CN(C2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCCNC(=O)CN(C2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C

InChI

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