N-[(3S,5S)-5-[(2S)-2-cyanopyrrolidin-1-yl]carbonylpyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: N-[(3S,5S)-5-[(2S)-2-cyanopyrrolidin-1-yl]carbonylpyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-[(3S,5S)-5-[(2S)-2-cyanopyrrolidine-1-carbonyl]pyrrolidin-3-yl]benzenesulfonamide CAS Name: N-[(3S,5S)-5-[[(2S)-2-cyano-1-pyrrolidinyl]-oxomethyl]-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: N-[(3S,5S)-5-[(2S)-2-cyanopyrrolidine-1-carbonyl]pyrrolidin-3-yl]benzenesulfonamide Traditional Name: N-[(3S,5S)-5-[(2S)-2-cyanopyrrolidine-1-carbonyl]pyrrolidin-3-yl]benzenesulfonamide Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)NS(=O)(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@@H]2C[C@@H](CN2)NS(=O)(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C16H20N4O3S/c17-10-13-5-4-8-20(13)16(21)15-9-12(11-18-15)19-24(22,23)14-6-2-1-3-7-14/h1-3,6-7,12-13,15,18-19H,4-5,8-9,11H2/t12-,13-,15-/m0/s1