Dimethyl Sulfoxide → HCID 68781143, compound

HRID 2157046Notes

Reaction equation

HRID 2157046 reaction equation
[CH3:47][S:48]([CH3:49])=[O:50].[CH:38]([N:39]([CH:40]([CH3:41])[CH3:42])[CH2:43][CH3:44])([CH3:45])[CH3:46].[OH2:51].[c:21]1(-[c:27]2[n:28][s:29][c:30]([N:32]3[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]3)[n:31]2)[cH:22][cH:23][cH:24][cH:25][cH:26]1.[n:1]1(-[c:6]2[cH:7][cH:8][c:9]([NH:12][C:13]([O:14][CH2:15][C:16]([Cl:17])([Cl:18])[Cl:19])=[O:20])[cH:10][cH:11]2)[cH:2][n:3][cH:4][cH:5]1>>[n:1]1(-[c:6]2[cH:7][cH:8][c:9]([NH:12][C:13](=[O:20])[N:35]3[CH2:34][CH2:33][N:32]([c:30]4[s:29][n:28][c:27](-[c:21]5[cH:22][cH:23][cH:24][cH:25][cH:26]5)[n:31]4)[CH2:37][CH2:36]3)[cH:10][cH:11]2)[cH:2][n:3][cH:4][cH:5]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 81531DiisopropylethylamineHCID 27777601-(3-Phenyl-(1,2,4)thiadiazol-5-yl)-piperazineHCID 86245060HCID 86245060, compound

Product 1

HCID 68781143HCID 68781143, compound

Sources & evidence

ORD record
ord-0608e871fb81497ca100d9787077f702
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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