4-(4-cyano-2-methoxy-phenoxy)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)butanamide

Systemtic Name: 4-(4-cyano-2-methoxy-phenoxy)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)butanamide Openeye Name: 4-(4-cyano-2-methoxy-phenoxy)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)butanamide CAS Name: 4-(4-cyano-2-methoxyphenoxy)-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]butanamide IUPAC Name: 4-(4-cyano-2-methoxyphenoxy)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)butanamide Traditional Name: 4-(4-cyano-2-methoxy-phenoxy)-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)butyramide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O6S/c1-30-21-13-16(15-23)6-9-20(21)31-12-4-5-22(27)24-18-14-17(7-8-19(18)26)32(28,29)25-10-2-3-11-25/h6-9,13-14,26H,2-5,10-12H2,1H3,(H,24,27)