Chloroform → HCID 74975113, compound

HRID 89360Notes

Reaction equation

HRID 89360 reaction equation
[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:50][n:51]1[c:52](=[O:66])[n:53]([CH:60]2[CH2:61][CH2:62][NH:63][CH2:64][CH2:65]2)[c:54]2[c:55]1[n:56][cH:57][cH:58][cH:59]2.[Cl:23][C:24](=[O:25])[O:26][c:27]1[cH:28][cH:29][c:30]([N+:31]([O-:32])=[O:33])[cH:34][cH:35]1.[Cl:72][CH:73]([Cl:74])[Cl:75].[F:43][C:44]([F:45])([F:46])[C:47]([OH:48])=[O:49].[NH2:1][CH:2]1[C:3](=[O:22])[N:4]([CH2:17][C:18]([F:19])([F:20])[F:21])[CH2:5][CH:6]([c:9]2[c:10]([F:16])[c:11]([F:15])[cH:12][cH:13][cH:14]2)[CH2:7][CH2:8]1>>[NH:1]([CH:2]1[C:3](=[O:22])[N:4]([CH2:17][C:18]([F:19])([F:20])[F:21])[CH2:5][CH:6]([c:9]2[c:10]([F:16])[c:11]([F:15])[cH:12][cH:13][cH:14]2)[CH2:7][CH2:8]1)[C:24](=[O:25])[N:63]1[CH2:62][CH2:61][CH:60]([n:53]2[c:52](=[O:66])[n:51]([CH3:50])[c:55]3[c:54]2[cH:59][cH:58][cH:57][n:56]3)[CH2:65][CH2:64]1

Participants

8

Reactant 7

HCID 6212ChloroformHCID 6422Trifluoroacetic acidHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 821294-Nitrophenyl chloroformateHCID 222931673-Amino-6-(2,3-difluorophenyl)-1-(2,2,2-trifluoroethyl)azepan-2-oneHCID 595851843-methyl-1-piperidin-4-yl-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

Product 1

HCID 74975113HCID 74975113, compound

Sources & evidence

ORD record
ord-1b1f3c3ffe974b3389796369873c35db
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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