N,N-Dimethylglycine → HCID 178518750, compound

HRID 1136982Notes

Reaction equation

HRID 1136982 reaction equation
[CH3:29][N:30]([CH2:31][C:32](=[O:33])[OH:34])[CH3:35].[CH3:55][S:56](=[O:57])[CH3:58].[CH3:59][CH2:60][O:61][C:62]([CH3:63])=[O:64].[Cu:65][I:66].[F:42][C:43]([c:44]1[n:45][nH:46][c:47]2[c:52]1[CH2:51][CH2:50][CH2:49][CH2:48]2)([F:53])[F:54].[I:1][c:2]1[c:3](=[O:28])[nH:4][c:5](=[O:27])[n:6]([CH2:8][CH2:9][CH2:10][N:11]2[CH2:12][C:13]3([c:17]4[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]4)[CH2:14][CH:15]3[CH2:16]2)[cH:7]1.[K+:36].[K+:37].[O-:38][C:39]([O-:40])=[O:41]>>[c:2]1(-[n:46]2[n:45][c:44]([C:43]([F:42])([F:53])[F:54])[c:52]3[c:47]2[CH2:48][CH2:49][CH2:50][CH2:51]3)[c:3](=[O:28])[nH:4][c:5](=[O:27])[n:6]([CH2:8][CH2:9][CH2:10][N:11]2[CH2:12][C:13]3([c:17]4[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]4)[CH2:14][CH:15]3[CH2:16]2)[cH:7]1

Participants

9

Reactant 8

HCID 673N,N-DimethylglycineHCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 28028633-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazoleHCID 710185655-Iodo-1-[3-[1-[4-(trifluoromethyl)phenyl]-3-azabicyclo[3.1.0]hexan-3-yl]propyl]pyrimidine-2,4-dione

Product 1

HCID 178518750HCID 178518750, compound

Sources & evidence

ORD record
ord-b496c9947f5b4f4fb7fc40672389ea59
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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