Hydrochloric Acid → HCID 72479906, compound

HRID 1549454Notes

Reaction equation

HRID 1549454 reaction equation
[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][C:51]([N:52]([CH3:53])[CH3:54])=[O:55].[Cl:4][c:5]1[cH:6][c:7]2[c:8]([CH2:14][n:15]3[n:16][c:17]4[n:18]([CH2:39][CH:40]5[CH2:41][CH2:42]5)[c:19](=[O:38])[n:20]([CH3:37])[c:21](=[O:36])[c:22]4[c:23]3-[c:24]3[n:25]([CH3:35])[cH:26][c:27]([C:29]([C:30]([F:31])([F:32])[F:33])=[O:34])[cH:28]3)[cH:9][nH:10][c:11]2[cH:12][cH:13]1.[ClH:1].[NH2:2][OH:3]>>[N:2]([OH:3])=[C:29]([c:27]1[cH:26][n:25]([CH3:35])[c:24](-[c:23]2[n:15]([CH2:14][c:8]3[c:7]4[cH:6][c:5]([Cl:4])[cH:13][cH:12][c:11]4[nH:10][cH:9]3)[n:16][c:17]3[n:18]([CH2:39][CH:40]4[CH2:41][CH2:42]4)[c:19](=[O:38])[n:20]([CH3:37])[c:21](=[O:36])[c:22]32)[cH:28]1)[C:30]([F:31])([F:32])[F:33]

Participants

6

Sources & evidence

ORD record
ord-2f99208d090c4ad0a10aa8f53161e8cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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