Water → HCID 19792180, compound

HRID 126585Notes

Reaction equation

HRID 126585 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][c:11]1[cH:12][cH:13][c:14](-[c:17]3[c:18]([C:23]#[N:24])[cH:19][cH:20][cH:21][cH:22]3)[cH:15][cH:16]1)[c:25]([CH2:29][Cl:30])[cH:26][cH:27][cH:28]2.[Na:31][C:32]#[N:33].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:34]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][c:11]1[cH:12][cH:13][c:14](-[c:17]3[c:18]([C:23]#[N:24])[cH:19][cH:20][cH:21][cH:22]3)[cH:15][cH:16]1)[c:25]([CH2:29][C:32]#[N:33])[cH:26][cH:27][cH:28]2

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 19792204HCID 19792204, compoundHCID 178511850HCID 178511850, compound

Product 1

HCID 19792180HCID 19792180, compound

Sources & evidence

ORD record
ord-80823efb18864158a710e84339818bd4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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