N-[[(1S,3R)-3-[[2-[(2S,4S)-2-cyano-4-fluoranyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]cyclopentyl]methyl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[[(1S,3R)-3-[[2-[(2S,4S)-2-cyano-4-fluoranyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]cyclopentyl]methyl]-1H-pyrrole-2-carboxamide Openeye Name: N-[[(1S,3R)-3-[[2-[(2S,4S)-2-cyano-4-fluoro-pyrrolidin-1-yl]-2-oxo-ethyl]amino]cyclopentyl]methyl]-1H-pyrrole-2-carboxamide CAS Name: N-[[(1S,3R)-3-[[2-[(2S,4S)-2-cyano-4-fluoro-1-pyrrolidinyl]-2-oxoethyl]amino]cyclopentyl]methyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[[(1S,3R)-3-[[2-[(2S,4S)-2-cyano-4-fluoropyrrolidin-1-yl]-2-oxoethyl]amino]cyclopentyl]methyl]-1H-pyrrole-2-carboxamide Traditional Name: N-[[(1S,3R)-3-[[2-[(2S,4S)-2-cyano-4-fluoro-pyrrolidino]-2-keto-ethyl]amino]cyclopentyl]methyl]-1H-pyrrole-2-carboxamide Formula: C18H24FN5O2 MolecularWeight: 361.413863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1CNC(=O)C2=CC=CN2)NCC(=O)N3CC(CC3C#N)F

Isomeric SMILES

C1C[C@H](C[C@H]1CNC(=O)C2=CC=CN2)NCC(=O)N3C[C@H](C[C@H]3C#N)F

InChI

InChI=1S/C18H24FN5O2/c19-13-7-15(8-20)24(11-13)17(25)10-22-14-4-3-12(6-14)9-23-18(26)16-2-1-5-21-16/h1-2,5,12-15,21-22H,3-4,6-7,9-11H2,(H,23,26)/t12-,13-,14+,15-/m0/s1