5-chloranyl-N-[(3R,5R)-1-cyano-5-propan-2-yl-pyrrolidin-3-yl]-2-methoxy-benzenesulfonamide

Systemtic Name: 5-chloranyl-N-[(3R,5R)-1-cyano-5-propan-2-yl-pyrrolidin-3-yl]-2-methoxy-benzenesulfonamide Openeye Name: 5-chloro-N-[(3R,5R)-1-cyano-5-isopropyl-pyrrolidin-3-yl]-2-methoxy-benzenesulfonamide CAS Name: 5-chloro-N-[(3R,5R)-1-cyano-5-propan-2-yl-3-pyrrolidinyl]-2-methoxybenzenesulfonamide IUPAC Name: 5-chloro-N-[(3R,5R)-1-cyano-5-propan-2-ylpyrrolidin-3-yl]-2-methoxybenzenesulfonamide Traditional Name: 5-chloro-N-[(3R,5R)-1-cyano-5-isopropyl-pyrrolidin-3-yl]-2-methoxy-benzenesulfonamide Formula: C15H20ClN3O3S MolecularWeight: 357.8556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CC(CN1C#N)NS(=O)(=O)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)[C@H]1C[C@H](CN1C#N)NS(=O)(=O)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C15H20ClN3O3S/c1-10(2)13-7-12(8-19(13)9-17)18-23(20,21)15-6-11(16)4-5-14(15)22-3/h4-6,10,12-13,18H,7-8H2,1-3H3/t12-,13-/m1/s1