2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-ethoxyphenyl)propyl]ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-ethoxyphenyl)propyl]ethanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-[3-(4-ethoxyphenyl)propyl]acetamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-ethoxyphenyl)propyl]acetamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-ethoxyphenyl)propyl]acetamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-(3-p-phenetylpropyl)acetamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCCNC(=O)CN(C2=CC(=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CCCNC(=O)CN(C2=CC(=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O4S/c1-5-28-21-10-8-19(9-11-21)7-6-12-23-22(25)16-24(29(4,26)27)20-14-17(2)13-18(3)15-20/h8-11,13-15H,5-7,12,16H2,1-4H3,(H,23,25)