1,2-Dichloroethane → HCID 178437752, compound

HRID 152806Notes

Reaction equation

HRID 152806 reaction equation
[CH2:23]([CH3:24])[c:25]1[n:26][c:27]([N:34]2[CH2:35][CH2:36][N:37]([CH3:40])[CH2:38][CH2:39]2)[c:28]([F:33])[c:29]([NH:31][NH2:32])[n:30]1.[CH2:51]([Cl:52])[CH2:53][Cl:54].[CH:1]1([CH2:6][CH:7]([C:8](=[O:9])[OH:10])[CH2:11][N:12]([O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH:21]=[O:22])[CH2:2][CH2:3][CH2:4][CH2:5]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[OH2:60].[OH:41][n:42]1[c:43]2[n:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[CH:1]1([CH2:6][CH:7]([C:8](=[O:10])[NH:32][NH:31][c:29]2[c:28]([F:33])[c:27]([N:34]3[CH2:35][CH2:36][N:37]([CH3:40])[CH2:38][CH2:39]3)[n:26][c:25]([CH2:23][CH3:24])[n:30]2)[CH2:11][N:12]([O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH:21]=[O:22])[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 962WaterHCID 6228DimethylformamideHCID 181649HOAtHCID 223901542-(Cyclopentylmethyl)-3-[formyl(phenylmethoxy)amino]propanoic acidHCID 669359752-Ethyl-5-fluoro-4-hydrazino-6-(4-methyl-1-piperazinyl)pyrimidine

Product 1

HCID 178437752HCID 178437752, compound

Sources & evidence

ORD record
ord-48cea77d5975482d9327d0351a20db13
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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