Acetonitrile → HCID 22181317, compound

HRID 285516Notes

Reaction equation

HRID 285516 reaction equation
[C:36]([CH2:37][CH:38]([CH3:39])[CH3:40])(=[O:41])[Cl:42].[CH3:43][C:44]#[N:45].[CH3:46][N:47]([c:48]1[cH:49][cH:50][n:51][cH:52][cH:53]1)[CH3:54].[CH:1]1([CH2:4][n:5]2[c:6]([CH:16]([CH3:17])[c:18]3[cH:19][cH:20][c:21]([O:24][CH2:25][CH3:26])[cH:22][cH:23]3)[n:7][c:8]3[c:9]2[cH:10][cH:11][c:12]([NH:14][CH3:15])[cH:13]3)[CH2:2][CH2:3]1.[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35]>>[CH:1]1([CH2:4][n:5]2[c:6]([CH:16]([CH3:17])[c:18]3[cH:19][cH:20][c:21]([O:24][CH2:25][CH3:26])[cH:22][cH:23]3)[n:7][c:8]3[c:9]2[cH:10][cH:11][c:12]([N:14]([CH3:15])[C:36]([CH2:37][CH:38]([CH3:39])[CH3:40])=[O:41])[cH:13]3)[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 142844-(Dimethylamino)pyridineHCID 66054Isovaleryl chlorideHCID 81531DiisopropylethylamineHCID 22181285HCID 22181285, compound

Product 1

HCID 22181317HCID 22181317, compound

Sources & evidence

ORD record
ord-c85c737d8c87437fbf3d1c3352947562
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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