Water → HCID 21890839, compound

HRID 2311840Notes

Reaction equation

HRID 2311840 reaction equation
[CH2:43]([CH3:44])[N:45]([CH2:46][CH2:47][NH2:48])[c:49]1[cH:50][c:51]([CH3:55])[cH:52][cH:53][cH:54]1.[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH:56]([Cl:57])([Cl:58])[Cl:59].[Cl:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([O:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:22][CH3:23])[c:17]([O:20][CH3:21])[cH:18][c:19]23)[cH:8]1.[Cl:31][C:32]([Cl:33])([O:34][C:35]([O:36][C:37]([Cl:38])([Cl:39])[Cl:40])=[O:41])[Cl:42].[OH2:60]>>[Cl:1][c:2]1[c:3]([NH:4][C:35](=[O:41])[NH:48][CH2:47][CH2:46][N:45]([CH2:43][CH3:44])[c:49]2[cH:50][c:51]([CH3:55])[cH:52][cH:53][cH:54]2)[cH:5][cH:6][c:7]([O:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:22][CH3:23])[c:17]([O:20][CH3:21])[cH:18][c:19]23)[cH:8]1

Participants

7

Reactant 6

HCID 962WaterHCID 6212ChloroformHCID 8471TriethylamineHCID 879841,2-Ethanediamine, N1-ethyl-N1-(3-methylphenyl)-HCID 94429TriphosgeneHCID 218898992-Chloro-4-((6,7-dimethoxyquinazolin-4-yl)oxy)aniline

Product 1

HCID 21890839HCID 21890839, compound

Sources & evidence

ORD record
ord-bca83cb5d149411c9b550d1fbf4b4674
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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