2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[2-[(4-chlorophenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-[2-[(4-chlorobenzyl)thio]ethyl]acetamide Formula: C18H20BrClN2O3S2 MolecularWeight: 491.85

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrClN2O3S2/c1-27(24,25)22(17-4-2-3-15(19)11-17)12-18(23)21-9-10-26-13-14-5-7-16(20)8-6-14/h2-8,11H,9-10,12-13H2,1H3,(H,21,23)