Acetyl chloride → HCID 16723056, compound

HRID 684460Notes

Reaction equation

HRID 684460 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([NH2:26])[cH:6][cH:7][c:8]1-[c:9]1[o:10][c:11](-[c:14]2[c:15](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:16][o:17][c:18]2[CH3:19])[n:12][n:13]1.[CH3:34][C:35]([Cl:36])=[O:37].[CH3:43][N:44]([CH3:45])[c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1.[CH:27]([NH:28][CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([NH:26][C:35]([CH3:34])=[O:37])[cH:6][cH:7][c:8]1-[c:9]1[o:10][c:11](-[c:14]2[c:15](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:16][o:17][c:18]2[CH3:19])[n:12][n:13]1

Participants

6

Reactant 5

HCID 6367Acetyl chlorideHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 142844-(Dimethylamino)pyridineHCID 167225873-Methoxy-4-[5-(5-methyl-3-phenyl-isoxazol-4-yl)-[1,3,4]oxadiazol-2-yl]-phenylamine

Product 1

HCID 16723056HCID 16723056, compound

Sources & evidence

ORD record
ord-125237d55b9a431a8b7d627e6c7b2b1e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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