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

Systemtic Name: 2-[(2,5-dimethoxyphenyl)-methylsulfonyl-amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(2,5-dimethoxy-N-methylsulfonyl-anilino)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-(2,5-dimethoxy-N-methylsulfonylanilino)-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2,5-dimethoxy-N-methylsulfonylanilino)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(N-mesyl-2,5-dimethoxy-anilino)-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C22H29N3O8S2 MolecularWeight: 527.61096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N(CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N(CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O8S2/c1-31-16-7-9-21(33-3)19(13-16)25(34(4,27)28)15-22(26)23-18-14-17(8-10-20(18)32-2)35(29,30)24-11-5-6-12-24/h7-10,13-14H,5-6,11-12,15H2,1-4H3,(H,23,26)