2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[(3-ethoxyphenyl)methyl]propanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[(3-ethoxyphenyl)methyl]propanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[(3-ethoxyphenyl)methyl]propanamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[(3-ethoxyphenyl)methyl]propanamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[(3-ethoxyphenyl)methyl]propanamide Traditional Name: N-(3-ethoxybenzyl)-2-(N-mesyl-2,5-dimethyl-anilino)propionamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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