3-cyano-4-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]benzenesulfonamide

Systemtic Name: 3-cyano-4-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]benzenesulfonamide Openeye Name: 3-cyano-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzenesulfonamide CAS Name: 3-cyano-4-[[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-2-pyrrolidinyl]methoxy]benzenesulfonamide IUPAC Name: 3-cyano-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzenesulfonamide Traditional Name: 3-cyano-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzenesulfonamide Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=C(C=C3)S(=O)(=O)N)C#N)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=C(C=C3)S(=O)(=O)N)C#N)C#N

InChI

InChI=1S/C18H21N5O4S/c19-9-12-8-15(28(21,25)26)4-6-17(12)27-11-13-3-5-16(22-13)18(24)23-7-1-2-14(23)10-20/h4,6,8,13-14,16,22H,1-3,5,7,11H2,(H2,21,25,26)