Ethyl Acetate → HCID 178508305, compound

HRID 211472Notes

Reaction equation

HRID 211472 reaction equation
[CH2:12]([Sn:13]([CH2:14][CH2:15][CH2:16][CH3:22])([c:17]1[o:18][cH:19][cH:20][cH:21]1)[CH2:23][CH2:24][CH2:25][CH3:26])[CH2:27][CH2:28][CH3:29].[CH3:30][N:31]1[CH2:32][CH2:33][CH2:34][C:35]1=[O:36].[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]([NH2:8])[n:7]1)[n:9][n:10][nH:11]2.[Pd:43]([Cl:44])[Cl:45].[c:46]1([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:60][cH:61][cH:62][cH:63][cH:64]1.[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1>>[c:2]1(-[c:17]2[o:18][cH:19][cH:20][cH:21]2)[c:3]2[c:4]([n:5][c:6]([NH2:8])[n:7]1)[n:9][n:10][nH:11]2

Participants

7

Reactant 6

HCID 8857Ethyl AcetateHCID 11776Triphenylphosphine2×HCID 13387N-methyl-2-pyrrolidoneHCID 24290Palladium ChlorideHCID 43936882-(Tributylstannyl)furanHCID 178508438HCID 178508438, compound

Product 1

HCID 178508305HCID 178508305, compound

Sources & evidence

ORD record
ord-68388873516040c9a7d41cc664ed021a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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