Ethyl Acetate → HCID 58447358, compound

HRID 183588Notes

Reaction equation

HRID 183588 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([Cl:13])[n:6][nH:7][c:8](=[O:12])[c:9]2[cH:10][cH:11]1.[CH3:31][CH2:32][O:33][C:34]([CH3:35])=[O:36].[O:14]1[CH2:15][CH2:16][N:17]([CH2:20][CH2:21][O:22][c:23]2[c:24]([CH2:25][NH2:26])[cH:27][cH:28][cH:29][cH:30]2)[CH2:18][CH2:19]1.[O:39]=[C:40]([CH:41]=[CH:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)[CH:49]=[CH:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[O:57]=[C:58]([CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)[CH:67]=[CH:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[O:75]=[C:76]([CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1)[CH:85]=[CH:86][c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1.[Pd:37].[Pd:38]>>[c:2]1([NH:26][CH2:25][c:24]2[c:23]([O:22][CH2:21][CH2:20][N:17]3[CH2:16][CH2:15][O:14][CH2:19][CH2:18]3)[cH:30][cH:29][cH:28][cH:27]2)[cH:3][c:4]2[c:5]([Cl:13])[n:6][nH:7][c:8](=[O:12])[c:9]2[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 8857Ethyl AcetateHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 7537544[2-(2-morpholinoethoxy)phenyl]methylamineHCID 533084876-Bromo-4-chlorophthalazin-1(2H)-one

Product 1

HCID 58447358HCID 58447358, compound

Sources & evidence

ORD record
ord-c577100a020d4d17862b8aa0dc6b9d00
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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