Dimethyl Sulfoxide → HCID 68776401, compound

HRID 1545731Notes

Reaction equation

HRID 1545731 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([NH:11][C:12]([O:13][CH2:14][C:15]([Cl:16])([Cl:17])[Cl:18])=[O:19])[cH:9][n:10]1.[CH2:20]([CH3:21])[c:22]1[c:23](-[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[n:24][c:25]([N:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[s:26]1.[CH3:49][S:50]([CH3:51])=[O:52].[CH:39]([N:40]([CH:41]([CH3:42])[CH3:43])[CH2:44][CH3:45])([CH3:46])[CH3:47].[OH2:48]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([NH:11][C:12](=[O:19])[N:30]2[CH2:29][CH2:28][N:27]([c:25]3[n:24][c:23](-[c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[c:22]([CH2:20][CH3:21])[s:26]3)[CH2:32][CH2:31]2)[cH:9][n:10]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 81531DiisopropylethylamineHCID 61780004HCID 61780004, compoundHCID 862452592,2,2-Trichloroethyl[6-(acetylamino)pyridin-3-yl]carbamate

Product 1

HCID 68776401HCID 68776401, compound

Sources & evidence

ORD record
ord-f84b8f59a32d470d9292ce963ad06b5b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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