5-cyano-N-[(2S)-3-(4-fluorophenyl)-1-oxidanylidene-1-(4-oxidanylpiperidin-1-yl)propan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

Systemtic Name: 5-cyano-N-[(2S)-3-(4-fluorophenyl)-1-oxidanylidene-1-(4-oxidanylpiperidin-1-yl)propan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide Openeye Name: 5-cyano-N-[(1S)-1-[(4-fluorophenyl)methyl]-2-(4-hydroxy-1-piperidyl)-2-oxo-ethyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide CAS Name: 5-cyano-N-[(2S)-3-(4-fluorophenyl)-1-(4-hydroxy-1-piperidinyl)-1-oxopropan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide IUPAC Name: 5-cyano-N-[(2S)-3-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide Traditional Name: 5-cyano-N-[(1S)-1-(4-fluorobenzyl)-2-(4-hydroxypiperidino)-2-keto-ethyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide Formula: C23H22FN5O3 MolecularWeight: 435.450883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)C(CC2=CC=C(C=C2)F)NC(=O)C3=CC4=C(N3)C=NC(=C4)C#N

Isomeric SMILES

C1CN(CCC1O)C(=O)[C@H](CC2=CC=C(C=C2)F)NC(=O)C3=CC4=C(N3)C=NC(=C4)C#N

InChI

InChI=1S/C23H22FN5O3/c24-16-3-1-14(2-4-16)9-20(23(32)29-7-5-18(30)6-8-29)28-22(31)19-11-15-10-17(12-25)26-13-21(15)27-19/h1-4,10-11,13,18,20,27,30H,5-9H2,(H,28,31)/t20-/m0/s1