2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[(3-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[(3-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[[3-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-[3-(pyrrolidine-1-carbonyl)benzyl]acetamide Formula: C22H27N3O4S MolecularWeight: 429.53248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCC2=CC=CC(=C2)C(=O)N3CCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCC2=CC=CC(=C2)C(=O)N3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O4S/c1-17-8-3-4-11-20(17)25(30(2,28)29)16-21(26)23-15-18-9-7-10-19(14-18)22(27)24-12-5-6-13-24/h3-4,7-11,14H,5-6,12-13,15-16H2,1-2H3,(H,23,26)