2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[2-[(4-methylphenyl)thio]ethyl]acetamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[2-(p-tolylthio)ethyl]acetamide Formula: C18H21ClN2O3S2 MolecularWeight: 412.95394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2O3S2/c1-14-6-8-17(9-7-14)25-11-10-20-18(22)13-21(26(2,23)24)16-5-3-4-15(19)12-16/h3-9,12H,10-11,13H2,1-2H3,(H,20,22)