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

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(3-bromo-N-methylsulfonyl-anilino)acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(3-bromo-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(3-bromo-N-mesyl-anilino)acetamide Formula: C18H21BrN2O3S2 MolecularWeight: 457.40494

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCSCC1=CC=CC=C1)C2=CC(=CC=C2)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCSCC1=CC=CC=C1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O3S2/c1-26(23,24)21(17-9-5-8-16(19)12-17)13-18(22)20-10-11-25-14-15-6-3-2-4-7-15/h2-9,12H,10-11,13-14H2,1H3,(H,20,22)