Hydrochloric Acid → HCID 57505875, compound

HRID 1544619Notes

Reaction equation

HRID 1544619 reaction equation
[Br:39][CH2:40][CH2:41][CH2:42][C:43](=[O:44])[O:45][CH2:46][CH3:47].[CH3:2][CH:3]([CH3:4])[O:5][c:6]1[c:7]([C:8]#[N:9])[cH:10][c:11](-[c:14]2[n:15][c:16](-[c:19]3[cH:20][c:21]4[c:22]([cH:28][cH:29]3)[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]4)[n:17][o:18]2)[cH:12][cH:13]1.[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[ClH:1].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[CH3:2][CH:3]([CH3:4])[O:5][c:6]1[c:7]([C:8]#[N:9])[cH:10][c:11](-[c:14]2[n:15][c:16](-[c:19]3[cH:20][c:21]4[c:22]([cH:28][cH:29]3)[CH2:23][CH2:24][N:25]([CH2:40][CH2:41][CH2:42][C:43](=[O:44])[O:45][CH2:46][CH3:47])[CH2:26][CH2:27]4)[n:17][o:18]2)[cH:12][cH:13]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 76300Ethyl 4-bromobutyrateHCID 81531DiisopropylethylamineHCID 44128905HCID 44128905, compound

Product 1

HCID 57505875HCID 57505875, compound

Sources & evidence

ORD record
ord-19cef5283ee54a1eb34df1948344c390
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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