Dichloromethane → HCID 59295393, compound

HRID 690761Notes

Reaction equation

HRID 690761 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[s:15][c:16]([CH2:20][O:21][c:22]3[cH:23][c:24]([Cl:30])[c:25]([C:28]#[N:29])[cH:26][cH:27]3)[c:17]([CH3:19])[n:18]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[C:31]([O:32][C:33]([N:34]1[CH2:35][CH2:36][CH:37]([c:38]2[s:39][c:40]([CH2:41][Cl:42])[c:43]([CH3:44])[n:45]2)[CH2:46][CH2:47]1)=[O:48])([CH3:49])([CH3:50])[CH3:51].[Cl:52][c:53]1[cH:54][c:55]([OH:56])[cH:57][cH:58][c:59]1[C:60]#[N:61].[Cl:69][CH2:70][Cl:71].[OH:62][C:63]([C:64]([F:65])([F:66])[F:67])=[O:68]>>[NH:8]1[CH2:9][CH2:10][CH:11]([c:14]2[s:15][c:16]([CH2:20][O:21][c:22]3[cH:23][c:24]([Cl:30])[c:25]([C:28]#[N:29])[cH:26][cH:27]3)[c:17]([CH3:19])[n:18]2)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 5927972-Chloro-4-hydroxybenzonitrileHCID 59295386HCID 59295386, compoundHCID 59295436HCID 59295436, compound

Product 1

HCID 59295393HCID 59295393, compound

Sources & evidence

ORD record
ord-19998c35afbc47aca6e452c48dc162ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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