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

Systemtic Name: 3-bromanyl-4-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]benzenesulfonamide Openeye Name: 3-bromo-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzenesulfonamide CAS Name: 3-bromo-4-[[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-2-pyrrolidinyl]methoxy]benzenesulfonamide IUPAC Name: 3-bromo-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzenesulfonamide Traditional Name: 3-bromo-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]benzenesulfonamide Formula: C17H21BrN4O4S MolecularWeight: 457.34204

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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)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C17H21BrN4O4S/c18-14-8-13(27(20,24)25)4-6-16(14)26-10-11-3-5-15(21-11)17(23)22-7-1-2-12(22)9-19/h4,6,8,11-12,15,21H,1-3,5,7,10H2,(H2,20,24,25)