N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(4-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-2-(4-methyl-N-methylsulfonylanilino)acetamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C21H27N3O6S2 MolecularWeight: 481.58558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O6S2/c1-16-6-8-17(9-7-16)24(31(3,26)27)15-21(25)22-19-14-18(10-11-20(19)30-2)32(28,29)23-12-4-5-13-23/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,22,25)