2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-[(4-isopropoxy-3-methoxy-phenyl)methyl]acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]acetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]acetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-(4-isopropoxy-3-methoxy-benzyl)acetamide Formula: C20H25BrN2O5S MolecularWeight: 485.3919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CNC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CNC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C)OC

InChI

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