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

Systemtic Name: (5S)-5-ethynyl-1-[2-[(4-methyl-1-pyridin-4-yl-piperidin-4-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (5S)-5-ethynyl-1-[2-[[4-methyl-1-(4-pyridyl)-4-piperidyl]amino]acetyl]pyrrolidine-2-carbonitrile CAS Name: (5S)-5-ethynyl-1-[2-[(4-methyl-1-pyridin-4-yl-4-piperidinyl)amino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (5S)-5-ethynyl-1-[2-[(4-methyl-1-pyridin-4-ylpiperidin-4-yl)amino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: (5S)-5-ethynyl-1-[2-[[4-methyl-1-(4-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=NC=C2)NCC(=O)N3C(CCC3C#N)C#C

Isomeric SMILES

CC1(CCN(CC1)C2=CC=NC=C2)NCC(=O)N3[C@@H](CCC3C#N)C#C

InChI

InChI=1S/C20H25N5O/c1-3-16-4-5-18(14-21)25(16)19(26)15-23-20(2)8-12-24(13-9-20)17-6-10-22-11-7-17/h1,6-7,10-11,16,18,23H,4-5,8-9,12-13,15H2,2H3/t16-,18?/m1/s1