2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(2-ethoxyphenyl)propyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(2-ethoxyphenyl)propyl]ethanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[3-(2-ethoxyphenyl)propyl]acetamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[3-(2-ethoxyphenyl)propyl]acetamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[3-(2-ethoxyphenyl)propyl]acetamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-(3-o-phenetylpropyl)acetamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCCNC(=O)CN(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1CCCNC(=O)CN(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O4S/c1-5-28-21-11-7-6-9-19(21)10-8-14-23-22(25)16-24(29(4,26)27)20-13-12-17(2)18(3)15-20/h6-7,9,11-13,15H,5,8,10,14,16H2,1-4H3,(H,23,25)