2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-homoveratryl-acetamide Formula: C19H23BrN2O5S MolecularWeight: 471.36532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CN(C2=CC=C(C=C2)Br)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CN(C2=CC=C(C=C2)Br)S(=O)(=O)C)OC

InChI

InChI=1S/C19H23BrN2O5S/c1-26-17-9-4-14(12-18(17)27-2)10-11-21-19(23)13-22(28(3,24)25)16-7-5-15(20)6-8-16/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)