Tetrahydrofuran → HCID 178470618, compound

HRID 1118737Notes

Reaction equation

HRID 1118737 reaction equation
[CH2:70]1[O:71][CH2:72][CH2:73][CH2:74]1.[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([F:16])[c:8]([N:10]([CH3:11])[CH2:12][CH2:13][CH2:14][OH:15])[n:9]1.[N:52]([C:53]([N:54]1[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]1)=[O:60])=[N:61][C:62]([N:63]1[CH2:64][CH2:65][CH2:66][CH2:67][CH2:68]1)=[O:69].[OH:17][c:18]1[cH:19][c:20]2[c:24]([cH:25][cH:26]1)[CH:23]([CH2:27][C:28](=[O:29])[O:30][CH2:31][CH3:32])[CH2:22][CH2:21]2.[c:33]1([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([F:16])[c:8]([N:10]([CH3:11])[CH2:12][CH2:13][CH2:14][O:15][c:18]2[cH:19][c:20]3[c:24]([cH:25][cH:26]2)[CH:23]([CH2:27][C:28](=[O:29])[O:30][CH2:31][CH3:32])[CH2:22][CH2:21]3)[n:9]1

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 730421,1'-(Azodicarbonyl)dipiperidineHCID 23529437Ethyl 2-(5-hydroxy-2,3-dihydro-1h-inden-1-yl)acetateHCID 866046002-Chloro-5-fluoro-6-[(3-hydroxypropyl)(methyl)amino]nicotinonitrile

Product 1

HCID 178470618HCID 178470618, compound

Sources & evidence

ORD record
ord-5483255f7a544aaeb946d555cd3993a3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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