(2S,4S,5S)-N-(cyanomethyl)-4-(1,3-dihydroisoindol-2-ylcarbonyl)-N-ethyl-5-methyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4S,5S)-N-(cyanomethyl)-4-(1,3-dihydroisoindol-2-ylcarbonyl)-N-ethyl-5-methyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4S,5S)-N-(cyanomethyl)-N-ethyl-4-(isoindoline-2-carbonyl)-5-methyl-pyrrolidine-2-carboxamide CAS Name: (2S,4S,5S)-N-(cyanomethyl)-4-[1,3-dihydroisoindol-2-yl(oxo)methyl]-N-ethyl-5-methyl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S,5S)-N-(cyanomethyl)-4-(1,3-dihydroisoindole-2-carbonyl)-N-ethyl-5-methylpyrrolidine-2-carboxamide Traditional Name: (2S,4S,5S)-N-(cyanomethyl)-N-ethyl-4-(isoindoline-2-carbonyl)-5-methyl-pyrrolidine-2-carboxamide Formula: C19H24N4O2 MolecularWeight: 340.41946

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#N)C(=O)C1CC(C(N1)C)C(=O)N2CC3=CC=CC=C3C2

Isomeric SMILES

CCN(CC#N)C(=O)[C@@H]1C[C@@H]([C@@H](N1)C)C(=O)N2CC3=CC=CC=C3C2

InChI

InChI=1S/C19H24N4O2/c1-3-22(9-8-20)19(25)17-10-16(13(2)21-17)18(24)23-11-14-6-4-5-7-15(14)12-23/h4-7,13,16-17,21H,3,9-12H2,1-2H3/t13-,16-,17-/m0/s1