1,1-Dichloroethane → HCID 86597261, compound

HRID 2128659Notes

Reaction equation

HRID 2128659 reaction equation
[CH3:28][C:29]1([OH:35])[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[Cl:36][CH:37]([Cl:38])[CH3:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[c:1]1([O:2][C:8]([NH:9][c:10]2[s:11][c:12]3[c:13]([N:21]4[CH2:22][CH2:23][O:24][CH2:25][CH2:26]4)[n:14][cH:15][c:16]([O:19][CH3:20])[c:17]3[n:18]2)=[O:27])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][c:10]1[s:11][c:12]2[c:13]([N:21]3[CH2:22][CH2:23][O:24][CH2:25][CH2:26]3)[n:14][cH:15][c:16]([O:19][CH3:20])[c:17]2[n:18]1)(=[O:27])[N:32]1[CH2:31][CH2:30][C:29]([CH3:28])([OH:35])[CH2:34][CH2:33]1

Participants

5

Sources & evidence

ORD record
ord-6cfba11c5bcf44278acd8d47f5a26138
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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