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

Systemtic Name: 2-[(2-ethoxyphenyl)-methylsulfonyl-amino]-N-[3-[(4-methylphenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-(2-ethoxy-N-methylsulfonyl-anilino)-N-[3-(p-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-(2-ethoxy-N-methylsulfonylanilino)-N-[3-[(4-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-(2-ethoxy-N-methylsulfonylanilino)-N-[3-[(4-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(2-ethoxy-N-mesyl-anilino)-N-[3-[(4-methylbenzyl)thio]propyl]acetamide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N(CC(=O)NCCCSCC2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1N(CC(=O)NCCCSCC2=CC=C(C=C2)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O4S2/c1-4-28-21-9-6-5-8-20(21)24(30(3,26)27)16-22(25)23-14-7-15-29-17-19-12-10-18(2)11-13-19/h5-6,8-13H,4,7,14-17H2,1-3H3,(H,23,25)