2-[(4-methoxyphenyl)-methylsulfonyl-amino]-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]ethanamide

Systemtic Name: 2-[(4-methoxyphenyl)-methylsulfonyl-amino]-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-(4-methoxy-N-methylsulfonyl-anilino)-N-[3-(o-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-(4-methoxy-N-methylsulfonylanilino)-N-[3-[(2-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-(4-methoxy-N-methylsulfonylanilino)-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(N-mesyl-4-methoxy-anilino)-N-[3-[(2-methylbenzyl)thio]propyl]acetamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCCCNC(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1CSCCCNC(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O4S2/c1-17-7-4-5-8-18(17)16-28-14-6-13-22-21(24)15-23(29(3,25)26)19-9-11-20(27-2)12-10-19/h4-5,7-12H,6,13-16H2,1-3H3,(H,22,24)