2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[(4-ethoxyphenyl)methyl]propanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[(4-ethoxyphenyl)methyl]propanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[(4-ethoxyphenyl)methyl]propanamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[(4-ethoxyphenyl)methyl]propanamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[(4-ethoxyphenyl)methyl]propanamide Traditional Name: N-(4-ethoxybenzyl)-2-(N-mesyl-2,5-dimethyl-anilino)propionamide Formula: C21H28N2O4S MolecularWeight: 404.52302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C(C)N(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C(C)N(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O4S/c1-6-27-19-11-9-18(10-12-19)14-22-21(24)17(4)23(28(5,25)26)20-13-15(2)7-8-16(20)3/h7-13,17H,6,14H2,1-5H3,(H,22,24)