(2S,4S)-4-fluoranyl-1-[2-[(2-methyl-4-oxidanylidene-4-piperidin-1-yl-butan-2-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S,4S)-4-fluoranyl-1-[2-[(2-methyl-4-oxidanylidene-4-piperidin-1-yl-butan-2-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S,4S)-1-[2-[[1,1-dimethyl-3-oxo-3-(1-piperidyl)propyl]amino]acetyl]-4-fluoro-pyrrolidine-2-carbonitrile CAS Name: (2S,4S)-4-fluoro-1-[2-[[2-methyl-4-oxo-4-(1-piperidinyl)butan-2-yl]amino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S,4S)-4-fluoro-1-[2-[(2-methyl-4-oxo-4-piperidin-1-ylbutan-2-yl)amino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: (2S,4S)-4-fluoro-1-[2-[(3-keto-1,1-dimethyl-3-piperidino-propyl)amino]acetyl]pyrrolidine-2-carbonitrile Formula: C17H27FN4O2 MolecularWeight: 338.420283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1CCCCC1)NCC(=O)N2CC(CC2C#N)F

Isomeric SMILES

CC(C)(CC(=O)N1CCCCC1)NCC(=O)N2C[C@H](C[C@H]2C#N)F

InChI

InChI=1S/C17H27FN4O2/c1-17(2,9-15(23)21-6-4-3-5-7-21)20-11-16(24)22-12-13(18)8-14(22)10-19/h13-14,20H,3-9,11-12H2,1-2H3/t13-,14-/m0/s1