Acetonitrile → HCID 22318237, compound

HRID 172389Notes

Reaction equation

HRID 172389 reaction equation
[CH3:42][C:43]#[N:44].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH:7]2[CH2:8][N:9]([CH2:13][CH:14]3[CH:15]([NH2:20])[CH2:16][O:17][CH2:18][CH2:19]3)[CH2:10][CH2:11][CH2:12]2)[cH:21][cH:22]1.[c:23]1([O:29][C:30](=[O:24])[NH:31][c:32]2[s:33][c:34]([C:38]([CH3:39])=[O:40])[c:35]([CH3:37])[n:36]2)[cH:25][cH:26][cH:27][cH:28][cH:41]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH:7]2[CH2:8][N:9]([CH2:13][CH:14]3[CH:15]([NH:20][C:30](=[O:29])[NH:31][c:32]4[s:33][c:34]([C:38]([CH3:39])=[O:40])[c:35]([CH3:37])[n:36]4)[CH2:16][O:17][CH2:18][CH2:19]3)[CH2:10][CH2:11][CH2:12]2)[cH:21][cH:22]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 22259036Phenyl (5-acetyl-4-methyl-1,3-thiazol-2-yl)carbamateHCID 178508081HCID 178508081, compound

Product 1

HCID 22318237HCID 22318237, compound

Sources & evidence

ORD record
ord-cb51dcd1ef124c77a5e0020cfbb32993
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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