N-[(2R)-2-cyano-3-methyl-butan-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(2R)-2-cyano-3-methyl-butan-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C16H23N3O4S2 MolecularWeight: 385.50152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)[C@](C)(C#N)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C16H23N3O4S2/c1-13(2)16(3,12-17)18-24(20,21)14-6-8-15(9-7-14)25(22,23)19-10-4-5-11-19/h6-9,13,18H,4-5,10-11H2,1-3H3/t16-/m0/s1