Dichloromethane → HCID 68652848, compound

HRID 2132145Notes

Reaction equation

HRID 2132145 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH:9]([CH2:23][N:24]2[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]2)[CH2:10][N:11]([c:14]2[cH:15][c:16]([O:21][CH3:22])[c:17]([Cl:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[Cl:31][c:32]1[c:33]([C:42]([F:43])([F:44])[F:45])[n:34][n:35]([CH2:38][C:39](=[O:40])[OH:41])[c:36]1[CH3:37].[Cl:79][CH2:80][Cl:81].[OH:82][C:83]([C:84]([F:85])([F:86])[F:87])=[O:88].[P-:55]([F:56])([F:57])([F:58])([F:59])([F:60])[F:61].[n:62]1([O:63][C:64]([N:65]([CH3:66])[CH3:67])=[N+:68]([CH3:69])[CH3:70])[c:71]2[n:72][cH:73][cH:74][cH:75][c:76]2[n:77][n:78]1>>[N:8]1([C:39]([CH2:38][n:35]2[n:34][c:33]([C:42]([F:43])([F:44])[F:45])[c:32]([Cl:31])[c:36]2[CH3:37])=[O:41])[CH:9]([CH2:23][N:24]2[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]2)[CH2:10][N:11]([c:14]2[cH:15][c:16]([O:21][CH3:22])[c:17]([Cl:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1

Participants

8

Reactant 7

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 1876853(4-Chloro-5-methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 68652643HCID 68652643, compound

Product 1

HCID 68652848HCID 68652848, compound

Sources & evidence

ORD record
ord-e7fab0eba2a042639b3e9829d839d622
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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