Ethanol → 3-(2-fluoro-4-iodo-phenylamino)-1-(2-triisopropylsilanyloxy-ethyl)-1H-pyrrolo[3,2-c]pyridine-2-carboxylic acid (2-vinyloxy-ethoxy)-amide

HRID 320704Notes

Reaction equation

HRID 320704 reaction equation
[CH2:78]1[O:79][CH2:80][CH2:81][CH2:82]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([NH:27][c:28]2[c:29]([F:35])[cH:30][c:31]([I:34])[cH:32][cH:33]2)[c:7]2[cH:8][n:9][cH:10][cH:11][c:12]2[n:13]1[CH2:14][CH2:15][O:16][Si:17]([CH:18]([CH3:19])[CH3:20])([CH:21]([CH3:22])[CH3:23])[CH:24]([CH3:25])[CH3:26].[CH3:45][CH2:46][N:47]=[C:48]=[N:49][CH2:50][CH2:51][CH2:52][N:53]([CH3:54])[CH3:55].[CH3:75][CH2:76][OH:77].[CH:38](=[CH2:39])[O:40][CH2:41][CH2:42][O:43][NH2:44].[CH:66]([N:67]([CH2:68][CH3:69])[CH:70]([CH3:71])[CH3:72])([CH3:73])[CH3:74].[Na+:37].[OH-:36].[OH:56][n:57]1[c:58]2[c:59]([cH:60][cH:61][cH:62][cH:63]2)[n:64][n:65]1>>[C:3](=[O:4])([c:5]1[c:6]([NH:27][c:28]2[c:29]([F:35])[cH:30][c:31]([I:34])[cH:32][cH:33]2)[c:7]2[cH:8][n:9][cH:10][cH:11][c:12]2[n:13]1[CH2:14][CH2:15][O:16][Si:17]([CH:18]([CH3:19])[CH3:20])([CH:21]([CH3:22])[CH3:23])[CH:24]([CH3:25])[CH3:26])[NH:44][O:43][CH2:42][CH2:41][O:40][CH:38]=[CH2:39]

Participants

10

Reactant 9

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 21867017O-(2-(Vinyloxy)ethyl)hydroxylamineHCID 595965243-(2-Fluoro-4-iodo-phenylamino)-1-(2-triisopropylsilanyloxy-ethyl)-1H-pyrrolo[3,2-c]pyridine-2-carboxylic acid methyl ester

Product 1

HCID 595966633-(2-fluoro-4-iodo-phenylamino)-1-(2-triisopropylsilanyloxy-ethyl)-1H-pyrrolo[3,2-c]pyridine-2-carboxylic acid (2-vinyloxy-ethoxy)-amide

Sources & evidence

ORD record
ord-25b8fd60c6664b5181658ab2d1c16883
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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