Dimethylformamide → HCID 59513421, compound

HRID 1558839Notes

Reaction equation

HRID 1558839 reaction equation
[C:27](=[O:28])([O:29][CH2:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[NH:37][CH2:38][C:39]#[CH:40].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([CH2:10][N:11]2[C:12](=[O:25])[NH:13][C:14]([CH3:17])([c:18]3[cH:19][c:20]([Br:24])[cH:21][cH:22][cH:23]3)[C:15]2=[O:16])[cH:7][cH:8][cH:9]1)=[O:26].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[Cu:52][I:53].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[Pd:54]([Cl:55])[Cl:56].[c:57]1([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:71][cH:72][cH:73][cH:74][cH:75]1.[c:76]1([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[cH:90][cH:91][cH:92][cH:93][cH:94]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([CH2:10][N:11]2[C:12](=[O:25])[NH:13][C:14]([CH3:17])([c:18]3[cH:19][c:20]([C:40]#[C:39][CH2:38][NH:37][C:27](=[O:28])[O:29][CH2:30][c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[cH:21][cH:22][cH:23]3)[C:15]2=[O:16])[cH:7][cH:8][cH:9]1)=[O:26]

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 11137906Benzyl prop-2-yn-1-ylcarbamateHCID 45605619HCID 45605619, compound

Product 1

HCID 59513421HCID 59513421, compound

Sources & evidence

ORD record
ord-26bb1e3cf70741a3a96b2678337441c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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