N-[(3,4-diethoxyphenyl)methyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-2-(4-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-2-(4-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-2-(4-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-(3,4-diethoxybenzyl)-2-(N-mesyl-4-methyl-anilino)acetamide Formula: C21H28N2O5S MolecularWeight: 420.52242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CN(C2=CC=C(C=C2)C)S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CN(C2=CC=C(C=C2)C)S(=O)(=O)C)OCC

InChI

InChI=1S/C21H28N2O5S/c1-5-27-19-12-9-17(13-20(19)28-6-2)14-22-21(24)15-23(29(4,25)26)18-10-7-16(3)8-11-18/h7-13H,5-6,14-15H2,1-4H3,(H,22,24)