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

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[3-[(3-chlorophenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[3-[(3-chlorophenyl)methylsulfanyl]propyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[3-[(3-chlorophenyl)methylthio]propyl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[3-[(3-chlorophenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-[3-[(3-chlorobenzyl)thio]propyl]acetamide Formula: C19H22BrClN2O3S2 MolecularWeight: 505.87658

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCSCC1=CC(=CC=C1)Cl)C2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCSCC1=CC(=CC=C1)Cl)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H22BrClN2O3S2/c1-28(25,26)23(18-8-6-16(20)7-9-18)13-19(24)22-10-3-11-27-14-15-4-2-5-17(21)12-15/h2,4-9,12H,3,10-11,13-14H2,1H3,(H,22,24)