Water → HCID 10073201, compound

HRID 191709Notes

Reaction equation

HRID 191709 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]([C:9](=[O:10])[N:11]1[CH2:12][CH:13]([OH:15])[CH2:14]1)[NH:16][C:17](=[O:18])[c:19]1[cH:20][c:21]2[c:22]([nH:23]1)[s:24][c:25]([Br:27])[cH:26]2.[CH3:35][Si:36]([CH3:37])([CH3:38])[C:39]#[CH:40].[CH:28]([NH:29][CH:30]([CH3:31])[CH3:32])([CH3:33])[CH3:34].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[OH2:41].[Pd:47]([Cl:48])[Cl:49].[c:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1.[c:69]1([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[cH:83][cH:84][cH:85][cH:86][cH:87]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]([C:9](=[O:10])[N:11]1[CH2:12][CH:13]([OH:15])[CH2:14]1)[NH:16][C:17](=[O:18])[c:19]1[cH:20][c:21]2[c:22]([nH:23]1)[s:24][c:25]([C:40]#[C:39][Si:36]([CH3:35])([CH3:37])[CH3:38])[cH:26]2

Participants

8

Reactant 7

HCID 962WaterHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 66111TrimethylsilylacetyleneHCID 178523181HCID 178523181, compound

Product 1

HCID 10073201HCID 10073201, compound

Sources & evidence

ORD record
ord-979d4f80ac1446f59d2da195698e2ec0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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