Water → HCID 22034140, compound

HRID 315493Notes

Reaction equation

HRID 315493 reaction equation
[CH3:39][N:40]1[CH2:41][CH2:42][CH2:43][C:44]1=[O:45].[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]([CH3:8])[n:7]1)[c:9](-[c:13]1[c:14]([CH3:22])[cH:15][c:16]([O:20][CH3:21])[cH:17][c:18]1[CH3:19])[cH:10][n:11]2[CH3:12].[NH2:23][CH2:24][CH2:25][NH:26][C:27]([CH2:28][c:29]1[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]1)=[O:37].[OH2:38]>>[c:2]1([NH:23][CH2:24][CH2:25][NH:26][C:27]([CH2:28][c:29]2[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]2)=[O:37])[c:3]2[c:4]([n:5][c:6]([CH3:8])[n:7]1)[c:9](-[c:13]1[c:14]([CH3:22])[cH:15][c:16]([O:20][CH3:21])[cH:17][c:18]1[CH3:19])[cH:10][n:11]2[CH3:12]

Participants

5

Reactant 4

HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 13028015HCID 13028015, compoundHCID 22034116HCID 22034116, compound

Product 1

HCID 22034140HCID 22034140, compound

Sources & evidence

ORD record
ord-d3043faa53644e1f82799b5974847df2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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