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

Systemtic Name: 2-[2-[(3-chlorophenyl)-methylsulfonyl-amino]ethanoyl-methyl-amino]-N-(3,4-diethoxyphenyl)ethanamide Openeye Name: 2-[[2-(3-chloro-N-methylsulfonyl-anilino)acetyl]-methyl-amino]-N-(3,4-diethoxyphenyl)acetamide CAS Name: 2-[[2-(3-chloro-N-methylsulfonylanilino)-1-oxoethyl]-methylamino]-N-(3,4-diethoxyphenyl)acetamide IUPAC Name: 2-[[2-(3-chloro-N-methylsulfonylanilino)acetyl]-methylamino]-N-(3,4-diethoxyphenyl)acetamide Traditional Name: 2-[[2-(3-chloro-N-mesyl-anilino)acetyl]-methyl-amino]-N-(3,4-diethoxyphenyl)acetamide Formula: C22H28ClN3O6S MolecularWeight: 497.99222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O6S/c1-5-31-19-11-10-17(13-20(19)32-6-2)24-21(27)14-25(3)22(28)15-26(33(4,29)30)18-9-7-8-16(23)12-18/h7-13H,5-6,14-15H2,1-4H3,(H,24,27)