Pyridine → HCID 66942116, compound

HRID 2312629Notes

Reaction equation

HRID 2312629 reaction equation
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:14][O:15][C:16]([CH:17]([CH2:18][c:19]1[cH:20][c:21]([Cl:30])[c:22]([NH2:29])[c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)[OH:31])=[O:32].[Cl:1][C:2](=[O:3])[O:4][c:5]1[cH:6][cH:7][c:8]([N+:9]([O-:10])=[O:11])[cH:12][cH:13]1.[NH:33]1[CH2:34][CH2:35][CH:36]([N:39]2[C:40](=[O:50])[NH:41][c:42]3[c:43]([cH:46][cH:47][cH:48][cH:49]3)[CH2:44][CH2:45]2)[CH2:37][CH2:38]1.[cH:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1>>[C:2](=[O:3])([O:31][CH:17]([C:16]([O:15][CH3:14])=[O:32])[CH2:18][c:19]1[cH:20][c:21]([Cl:30])[c:22]([NH2:29])[c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)[N:33]1[CH2:34][CH2:35][CH:36]([N:39]2[C:40](=[O:50])[NH:41][c:42]3[c:43]([cH:46][cH:47][cH:48][cH:49]3)[CH2:44][CH2:45]2)[CH2:37][CH2:38]1

Participants

6

Reactant 5

HCID 1049PyridineHCID 8028TetrahydrofuranHCID 821294-Nitrophenyl chloroformateHCID 113795873-(Piperidin-4-yl)-4,5-dihydro-1H-benzo[d][1,3]diazepin-2(3H)-oneHCID 77201872HCID 77201872, compound

Product 1

HCID 66942116HCID 66942116, compound

Sources & evidence

ORD record
ord-46f5a84ee4b34da0a7e94bc5174e33ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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