Water → HCID 68964849, compound

HRID 299544Notes

Reaction equation

HRID 299544 reaction equation
[CH2:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[N:27]1[CH2:28][CH:29]([NH2:32])[CH2:30][CH2:31]1.[CH3:1][c:2]1[n:3][c:4]([S:18][CH3:19])[n:5][cH:6][c:7]1[C:8](=[O:9])[O:10][CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1.[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[OH2:39]>>[CH3:1][c:2]1[n:3][c:4]([NH:32][CH:29]2[CH2:28][N:27]([CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:31][CH2:30]2)[n:5][cH:6][c:7]1[C:8](=[O:9])[O:10][CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1

Participants

6

Reactant 5

HCID 962WaterHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 27566131-Benzyl-3-aminopyrrolidineHCID 68967730HCID 68967730, compound

Product 1

HCID 68964849HCID 68964849, compound

Sources & evidence

ORD record
ord-d73cbc83ea4a459e9b7a40bbc98d1e4f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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