2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)-N-homoveratryl-acetamide Formula: C20H25BrN2O5S MolecularWeight: 485.3919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CC(=O)NCCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(CC(=O)NCCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C)Br

InChI

InChI=1S/C20H25BrN2O5S/c1-14-11-16(6-7-17(14)21)23(29(4,25)26)13-20(24)22-10-9-15-5-8-18(27-2)19(12-15)28-3/h5-8,11-12H,9-10,13H2,1-4H3,(H,22,24)