2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[2-[(4-methylphenyl)thio]ethyl]acetamide IUPAC Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)-N-[2-(p-tolylthio)ethyl]acetamide Formula: C19H23BrN2O3S2 MolecularWeight: 471.43152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrN2O3S2/c1-14-4-7-17(8-5-14)26-11-10-21-19(23)13-22(27(3,24)25)16-6-9-18(20)15(2)12-16/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)