(2S,5R)-5-ethynyl-1-[2-[(4-methyl-1-pyridin-2-yl-piperidin-4-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S,5R)-5-ethynyl-1-[2-[(4-methyl-1-pyridin-2-yl-piperidin-4-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S,5R)-5-ethynyl-1-[2-[[4-methyl-1-(2-pyridyl)-4-piperidyl]amino]acetyl]pyrrolidine-2-carbonitrile CAS Name: (2S,5R)-5-ethynyl-1-[2-[[4-methyl-1-(2-pyridinyl)-4-piperidinyl]amino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S,5R)-5-ethynyl-1-[2-[(4-methyl-1-pyridin-2-ylpiperidin-4-yl)amino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: (2S,5R)-5-ethynyl-1-[2-[[4-methyl-1-(2-pyridyl)-4-piperidyl]amino]acetyl]pyrrolidine-2-carbonitrile Formula: C20H25N5O MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C2=CC=CC=N2)NCC(=O)N3C(CCC3C#N)C#C

Isomeric SMILES

CC1(CCN(CC1)C2=CC=CC=N2)NCC(=O)N3[C@H](CC[C@H]3C#N)C#C

InChI

InChI=1S/C20H25N5O/c1-3-16-7-8-17(14-21)25(16)19(26)15-23-20(2)9-12-24(13-10-20)18-6-4-5-11-22-18/h1,4-6,11,16-17,23H,7-10,12-13,15H2,2H3/t16-,17-/m0/s1