Dichloromethane → HCID 178509937, compound

HRID 155798Notes

Reaction equation

[CH3:8][C:9]([O:10][C:11]([N:15]([C:12]([O:13][C:14]([CH3:16])([CH3:17])[CH3:18])=[O:19])[c:23]1[nH:24][cH:25][c:26]([C:28](=[O:29])[NH:30][CH2:31][c:32]2[c:33]([F:49])[c:34]([O:39][c:40]3[cH:41][c:42]([Cl:48])[cH:43][c:44]([C:46]#[N:47])[cH:45]3)[c:35]([Cl:38])[cH:36][cH:37]2)[n:27]1)=[O:20])([CH3:21])[CH3:22].[Cl:50][CH2:51][Cl:52].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[NH2:15][c:23]1[nH:24][cH:25][c:26]([C:28](=[O:29])[NH:30][CH2:31][c:32]2[c:33]([F:49])[c:34]([O:39][c:40]3[cH:41][c:42]([Cl:48])[cH:43][c:44]([C:46]#[N:47])[cH:45]3)[c:35]([Cl:38])[cH:36][cH:37]2)[n:27]1

Participants

Reactant 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 178454350bis(1,1-dimethylethyl) (4-{[({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]-2-fluorophenyl}methyl)amino]carbonyl}-1H-imidazol-2-yl)imidodicarbonate

Product 1

HCID 178509937HCID 178509937, compound

Sources & evidence

ORD record: ord-d765f5ac33e24477bcad72d6c98db02e
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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