Dimethyl Sulfoxide → HCID 86625477, compound

HRID 1121307Notes

Reaction equation

HRID 1121307 reaction equation
[CH3:46][S:47](=[O:48])[CH3:49].[CH:36]([N:37]([CH:38]([CH3:39])[CH3:40])[CH2:41][CH3:42])([CH3:43])[CH3:44].[OH2:45].[c:19]1(-[c:25]2[n:26][s:27][c:28]([N:30]3[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]3)[n:29]2)[cH:20][cH:21][cH:22][cH:23][cH:24]1.[s:1]1[c:2]([NH:10][C:11]([O:12][CH2:13][C:14]([Cl:15])([Cl:16])[Cl:17])=[O:18])[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[s:1]1[c:2]([NH:10][C:11](=[O:18])[N:33]2[CH2:32][CH2:31][N:30]([c:28]3[s:27][n:26][c:25](-[c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[n:29]3)[CH2:35][CH2:34]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 81531DiisopropylethylamineHCID 27777601-(3-Phenyl-(1,2,4)thiadiazol-5-yl)-piperazineHCID 86245184HCID 86245184, compound

Product 1

HCID 86625477HCID 86625477, compound

Sources & evidence

ORD record
ord-a0ccaafe00794dd98839dfaec2cbef02
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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