2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]ethanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-2-(N-mesyl-3,4-dimethyl-anilino)acetamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCC2=CC(=CC=C2)N3CCCC3=O)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCC2=CC(=CC=C2)N3CCCC3=O)S(=O)(=O)C)C

InChI

InChI=1S/C22H27N3O4S/c1-16-9-10-20(12-17(16)2)25(30(3,28)29)15-21(26)23-14-18-6-4-7-19(13-18)24-11-5-8-22(24)27/h4,6-7,9-10,12-13H,5,8,11,14-15H2,1-3H3,(H,23,26)