Acetate → 3-(4-Amino-3-bromothieno[3,2-c]pyridin-7-yl)prop-2-enenitrile

HRID 214304Notes

Reaction equation

[Br:1][c:2]1[cH:3][s:4][c:5]2[c:6]1[c:7]([NH2:12])[n:8][cH:9][c:10]2[I:11].[CH2:38]=[CH:39][C:40]#[N:41].[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[O-:48][C:49]([CH3:50])=[O:51].[O-:52][C:53]([CH3:54])=[O:55].[Pd+2:47].[c:13]1([P:14]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[Br:1][c:2]1[cH:3][s:4][c:5]2[c:6]1[c:7]([NH2:12])[n:8][cH:9][c:10]2[CH:38]=[CH:39][C:40]#[N:41]

Participants

Reactant 8

HCID 175Acetate2×

HCID 923Sodium ion2×

HCID 6228Dimethylformamide

HCID 7855Acrylonitrile

HCID 11776Triphenylphosphine

HCID 19660Carbonate Ion

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

HCID 184507913-Bromo-7-iodothieno[3,2-C]pyridin-4-amine

Product 1

HCID 686764233-(4-Amino-3-bromothieno[3,2-c]pyridin-7-yl)prop-2-enenitrile

Sources & evidence

ORD record: ord-ea8e12b65df94bc7a45d1bc0383bd71f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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