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

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-2-[(3-ethanoylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: 2-(3-acetyl-N-methylsulfonyl-anilino)-N-(2-cyclohexylsulfanylethyl)acetamide CAS Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-[2-(cyclohexylthio)ethyl]acetamide IUPAC Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-(2-cyclohexylsulfanylethyl)acetamide Traditional Name: 2-(3-acetyl-N-mesyl-anilino)-N-[2-(cyclohexylthio)ethyl]acetamide Formula: C19H28N2O4S2 MolecularWeight: 412.56662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(CC(=O)NCCSC2CCCCC2)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(CC(=O)NCCSC2CCCCC2)S(=O)(=O)C

InChI

InChI=1S/C19H28N2O4S2/c1-15(22)16-7-6-8-17(13-16)21(27(2,24)25)14-19(23)20-11-12-26-18-9-4-3-5-10-18/h6-8,13,18H,3-5,9-12,14H2,1-2H3,(H,20,23)