N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C[C@](C#N)(C1CC1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H21N3O4S2/c1-16(12-17,13-4-5-13)18-24(20,21)14-6-8-15(9-7-14)25(22,23)19-10-2-3-11-19/h6-9,13,18H,2-5,10-11H2,1H3/t16-/m0/s1