Water → But-2-yn-1-yl {6-[({[(4-methyl-1,2,5-thiadiazol-3-yl)(phenyl)methylidene]-amino}oxy)methyl]pyridin-2-yl}carbamate

HRID 2162474Notes

Reaction equation

HRID 2162474 reaction equation
[C:30]([O:31][CH2:32][C:33]#[C:34][CH3:35])(=[O:36])[Cl:37].[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[CH3:1][c:2]1[c:3]([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)=[N:14][O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][c:21]([NH2:23])[n:22]2)[n:4][s:5][n:6]1.[Cl:44][CH2:45][Cl:46].[OH2:47].[cH:24]1[cH:25][cH:26][n:27][cH:28][cH:29]1>>[CH3:1][c:2]1[c:3]([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)=[N:14][O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][c:21]([NH:23][C:30]([O:31][CH2:32][C:33]#[C:34][CH3:35])=[O:36])[n:22]2)[n:4][s:5][n:6]1

Participants

7

Reactant 6

HCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 41316692-Butyn-1-yl chloroformateHCID 914822806-[[[(4-Methyl-1,2,5-thiadiazol-3-yl)-phenylmethylidene]amino]oxymethyl]pyridin-2-amine

Product 1

HCID 86659838But-2-yn-1-yl {6-[({[(4-methyl-1,2,5-thiadiazol-3-yl)(phenyl)methylidene]-amino}oxy)methyl]pyridin-2-yl}carbamate

Sources & evidence

ORD record
ord-326c00b109a448ebb48c2579fd943997
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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