Dimethyl Sulfoxide → HCID 59420874, compound

HRID 307883Notes

Reaction equation

HRID 307883 reaction equation
[CH3:53][S:54]([CH3:55])=[O:56].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Cl:25][C:26]([Cl:27])([Cl:41])[CH2:42][O:28][C:29]([NH:30][c:31]1[n:32]([CH3:40])[n:33][c:34]([C:36]([CH3:37])([CH3:38])[CH3:39])[cH:35]1)=[O:43].[NH2:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]2[CH2:8][CH2:9][N:10]([C:13](=[O:14])[c:15]3[c:16]([Cl:22])[cH:17][cH:18][cH:19][c:20]3[Cl:21])[CH2:11][CH2:12]2)[cH:23][cH:24]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]2[CH2:8][CH2:9][N:10]([C:13](=[O:14])[c:15]3[c:16]([Cl:22])[cH:17][cH:18][cH:19][c:20]3[Cl:21])[CH2:11][CH2:12]2)[cH:23][cH:24]1)[C:29](=[O:28])[NH:30][c:31]1[n:32]([CH3:40])[n:33][c:34]([C:36]([CH3:37])([CH3:38])[CH3:39])[cH:35]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 81531DiisopropylethylamineHCID 23103401HCID 23103401, compoundHCID 594208722,2,2-Trichloroethyl (3-tert-butyl-1-methyl-1H-pyrazol-5-yl)carbamate

Product 1

HCID 59420874HCID 59420874, compound

Sources & evidence

ORD record
ord-bf811dc7dff84ac08cae535a7790089f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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