(2S,5S)-5-ethynyl-1-[2-(2,4,4-trimethylpentan-2-ylamino)ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S,5S)-5-ethynyl-1-[2-(2,4,4-trimethylpentan-2-ylamino)ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S,5S)-5-ethynyl-1-[2-(1,1,3,3-tetramethylbutylamino)acetyl]pyrrolidine-2-carbonitrile CAS Name: (2S,5S)-5-ethynyl-1-[1-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S,5S)-5-ethynyl-1-[2-(2,4,4-trimethylpentan-2-ylamino)acetyl]pyrrolidine-2-carbonitrile Traditional Name: (2S,5S)-5-ethynyl-1-[2-(1,1,3,3-tetramethylbutylamino)acetyl]pyrrolidine-2-carbonitrile Formula: C17H27N3O MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NCC(=O)N1C(CCC1C#N)C#C

Isomeric SMILES

CC(C)(C)CC(C)(C)NCC(=O)N1[C@@H](CC[C@H]1C#N)C#C

InChI

InChI=1S/C17H27N3O/c1-7-13-8-9-14(10-18)20(13)15(21)11-19-17(5,6)12-16(2,3)4/h1,13-14,19H,8-9,11-12H2,2-6H3/t13-,14+/m1/s1