1,2-Dichloroethane → HCID 11577035, compound

HRID 1554587Notes

Reaction equation

HRID 1554587 reaction equation
[CH2:50]([Cl:51])[CH2:52][Cl:53].[CH3:1][N:2]1[CH2:3][CH2:4][N:5]=[C:6]1[c:7]1[cH:8][cH:9][c:10]([NH:13][C:14]([CH:15]([NH:16][C:17](=[O:18])[NH:19][c:20]2[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]2)[c:27]2[c:28]([CH3:33])[cH:29][cH:30][cH:31][cH:32]2)=[O:34])[cH:11][cH:12]1.[CH3:35][N:36]1[CH2:37][CH2:38][N:39]([c:43]2[cH:44][cH:45][c:46]([NH2:47])[cH:48][cH:49]2)[CH2:40][CH2:41][CH2:42]1.[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[OH2:59]>>[c:7]1([N:39]2[CH2:38][CH2:37][N:36]([CH3:35])[CH2:42][CH2:41][CH2:40]2)[cH:8][cH:9][c:10]([NH:13][C:14]([CH:15]([NH:16][C:17](=[O:18])[NH:19][c:20]2[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]2)[c:27]2[c:28]([CH3:33])[cH:29][cH:30][cH:31][cH:32]2)=[O:34])[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 962WaterHCID 6228DimethylformamideHCID 130079514-(4-Methyl-1,4-diazepan-1-yl)anilineHCID 58674790HCID 58674790, compound

Product 1

HCID 11577035HCID 11577035, compound

Sources & evidence

ORD record
ord-d0493b5a2ad54cac969f1ff7ae1323cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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