Ammonium → HCID 77296025, compound

HRID 2338667Notes

Reaction equation

HRID 2338667 reaction equation
[CH2:8]([CH3:9])[O:10][C:11](=[O:12])[N:13]1[CH2:14][CH2:15][N:16]([C:19]([CH:20]([CH2:21][CH2:22][C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[NH:30][C:31](=[O:32])[c:33]2[n:34][c:35](-[c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[n:36][c:37]([Cl:39])[cH:38]2)=[O:46])[CH2:17][CH2:18]1.[CH3:1][Si:2]([CH3:3])([CH3:4])[C:5]#[CH:6].[Cl-:47].[I-:7].[NH4+:48].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[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][Si:2]([CH3:3])([CH3:4])[C:5]#[C:6][c:37]1[n:36][c:35](-[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[n:34][c:33]([C:31]([NH:30][CH:20]([C:19]([N:16]2[CH2:15][CH2:14][N:13]([C:11]([O:10][CH2:8][CH3:9])=[O:12])[CH2:18][CH2:17]2)=[O:46])[CH2:21][CH2:22][C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:32])[cH:38]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 6228DimethylformamideHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 30165Iodide IonHCID 66111TrimethylsilylacetyleneHCID 87402957Ethyl 4-[2-[(6-chloro-2-phenylpyrimidine-4-carbonyl)amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]piperazine-1-carboxylate

Product 1

HCID 77296025HCID 77296025, compound

Sources & evidence

ORD record
ord-7f3ea045808242b486eda639c8447fc1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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