Potassium Cation → HCID 57832680, compound

HRID 110042

Reaction equation

HRID 110042 reaction equation
[C:18](=[O:19])([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[N:25]1[CH:26]2[CH2:27][NH:28][CH:29]([CH2:30]1)[CH2:31]2.[CH3:48][N:49]1[CH2:50][CH2:51][CH2:52][C:53]1=[O:54].[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[Cl:1][c:2]1[n:3][c:4](-[c:11]2[cH:12][c:13]([Cl:17])[n:14][cH:15][cH:16]2)[cH:5][c:6]2[n:7]1[cH:8][cH:9][n:10]2.[K+:32].[K+:33].[O-:34][C:35]([O-:36])=[O:37].[OH2:47]>>[c:2]1([N:28]2[CH2:27][CH:26]3[N:25]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:30][CH:29]2[CH2:31]3)[n:3][c:4](-[c:11]2[cH:12][c:13]([Cl:17])[n:14][cH:15][cH:16]2)[cH:5][c:6]2[n:7]1[cH:8][cH:9][n:10]2

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 19660Carbonate IonHCID 81531DiisopropylethylamineHCID 2760898(1S,4S)-tert-butyl 2,5-diazabicyclo(2.2.1)heptane-2-carboxylateHCID 57832671HCID 57832671, compound

Product 1

HCID 57832680HCID 57832680, compound

Sources & evidence

ORD record
ord-b4e0980896b04564afae96479e0f9d20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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