2-[(4-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-[(4-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(4-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[2-(p-tolylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(4-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-[(4-methylphenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(4-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(4-chloro-N-mesyl-2-methyl-anilino)-N-[2-[(4-methylbenzyl)thio]ethyl]acetamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)CN(C2=C(C=C(C=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)CN(C2=C(C=C(C=C2)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C20H25ClN2O3S2/c1-15-4-6-17(7-5-15)14-27-11-10-22-20(24)13-23(28(3,25)26)19-9-8-18(21)12-16(19)2/h4-9,12H,10-11,13-14H2,1-3H3,(H,22,24)