2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide Traditional Name: 2-[brosyl(phenethyl)amino]-N-veratryl-acetamide Formula: C25H27BrN2O5S MolecularWeight: 547.46128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C25H27BrN2O5S/c1-32-23-13-8-20(16-24(23)33-2)17-27-25(29)18-28(15-14-19-6-4-3-5-7-19)34(30,31)22-11-9-21(26)10-12-22/h3-13,16H,14-15,17-18H2,1-2H3,(H,27,29)