Ammonia → HCID 53654624, compound

HRID 2143799Notes

Reaction equation

HRID 2143799 reaction equation
[CH3:55][CH2:56][OH:57].[NH3:48].[O-:37][S:38]([c:39]1[cH:40][cH:41][c:42]([CH3:43])[cH:44][cH:45]1)(=[O:46])=[O:47].[OH2:58].[S:26]([Cl:27])([c:28]1[cH:29][cH:30][c:31]([CH3:32])[cH:33][cH:34]1)(=[O:35])=[O:36].[c:1]1([CH:7]2[CH:8]3[C:9](=[N:10][N:11]2[CH2:12][CH2:13][OH:14])[C:15](=[CH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:16][S:17][CH2:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1>>[c:1]1([CH:7]2[CH:8]3[C:9](=[N:10][N:11]2[CH2:12][CH2:13][NH2:48])[C:15](=[CH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:16][S:17][CH2:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 222AmmoniaHCID 702EthanolHCID 962WaterHCID 1049PyridineHCID 73974-Toluenesulfonyl chlorideHCID 85570p-ToluenesulfonateHCID 53745416HCID 53745416, compound

Product 1

HCID 53654624HCID 53654624, compound

Sources & evidence

ORD record
ord-9d7cd6ea3db24a8898759274654edebc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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