Acetonitrile → HCID 178425899, compound

HRID 1551543Notes

Reaction equation

HRID 1551543 reaction equation
[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[CH3:29][c:30]1[cH:31][cH:32][c:33]([C:34](=[O:35])[Cl:36])[cH:37][cH:38]1.[CH3:39][N:40]([CH3:41])[c:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1.[CH3:48][C:49]#[N:50].[CH:1]1([CH2:4][NH:5][c:6]2[c:7]3[n:8][cH:9][n:10]([CH:15]4[O:16][CH:17]([CH2:20][OH:21])[CH2:18][CH2:19]4)[c:11]3[n:12][cH:13][n:14]2)[CH2:2][CH2:3]1>>[CH:1]1([CH2:4][NH:5][c:6]2[c:7]3[n:8][cH:9][n:10]([CH:15]4[O:16][CH:17]([CH2:20][O:21][C:34]([c:33]5[cH:32][cH:31][c:30]([CH3:29])[cH:38][cH:37]5)=[O:35])[CH2:18][CH2:19]4)[c:11]3[n:12][cH:13][n:14]2)[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 134054-Methylbenzoyl ChlorideHCID 142844-(Dimethylamino)pyridineHCID 19780634HCID 19780634, compound

Product 1

HCID 178425899HCID 178425899, compound

Sources & evidence

ORD record
ord-cfa8ccf4eba34e28a57e43c31d0e48fd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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