Hydrochloric Acid → HCID 58486069, compound

HRID 665236Notes

Reaction equation

HRID 665236 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[n:8]([CH2:12][c:13]1[cH:14][c:15](-[c:19]3[n:20][cH:21][c:22]([N:25]4[CH2:26][CH2:27][N:28]([C:31]([O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[CH2:29][CH2:30]4)[cH:23][n:24]3)[cH:16][cH:17][cH:18]1)[c:9](=[O:11])[o:10]2.[CH3:39][C:40]#[N:41].[ClH:38].[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[n:8]([CH2:12][c:13]1[cH:14][c:15](-[c:19]3[n:20][cH:21][c:22]([N:25]4[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]4)[cH:23][n:24]3)[cH:16][cH:17][cH:18]1)[c:9](=[O:11])[o:10]2

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 312751,4-DioxaneHCID 58486075HCID 58486075, compound

Product 1

HCID 58486069HCID 58486069, compound

Sources & evidence

ORD record
ord-e197a359ad674aefad1552499291b11c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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