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

Systemtic Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-(4-ethyl-N-methylsulfonyl-anilino)-N-[3-(o-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-(4-ethyl-N-methylsulfonylanilino)-N-[3-[(2-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-(4-ethyl-N-methylsulfonylanilino)-N-[3-[(2-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(4-ethyl-N-mesyl-anilino)-N-[3-[(2-methylbenzyl)thio]propyl]acetamide Formula: C22H30N2O3S2 MolecularWeight: 434.6152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC=CC=C2C)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC=CC=C2C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O3S2/c1-4-19-10-12-21(13-11-19)24(29(3,26)27)16-22(25)23-14-7-15-28-17-20-9-6-5-8-18(20)2/h5-6,8-13H,4,7,14-17H2,1-3H3,(H,23,25)