2-[(3-bromophenyl)-methylsulfonyl-amino]-N-(2-cyclohexylsulfanylethyl)ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-(2-cyclohexylsulfanylethyl)ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-(2-cyclohexylsulfanylethyl)acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[2-(cyclohexylthio)ethyl]acetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-(2-cyclohexylsulfanylethyl)acetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-[2-(cyclohexylthio)ethyl]acetamide Formula: C17H25BrN2O3S2 MolecularWeight: 449.426

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCSC1CCCCC1)C2=CC(=CC=C2)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCSC1CCCCC1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H25BrN2O3S2/c1-25(22,23)20(15-7-5-6-14(18)12-15)13-17(21)19-10-11-24-16-8-3-2-4-9-16/h5-7,12,16H,2-4,8-11,13H2,1H3,(H,19,21)