Water → HCID 68431249, compound

HRID 1219295Notes

Reaction equation

HRID 1219295 reaction equation
[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[CH:1]1([S:4](=[O:5])(=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH:13]([CH2:14][CH:15]3[CH2:16][CH2:17][O:18][CH2:19][CH2:20]3)[c:21]3[nH:22][c:23](-[c:29]4[s:30][cH:31][cH:32][n:33]4)[cH:24][c:25]3[C:26](=[O:27])[NH2:28])[cH:11][cH:12]2)[CH2:2][CH2:3]1.[OH2:34]>>[CH:1]1([S:4](=[O:5])(=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH:13]([CH2:14][CH:15]3[CH2:16][CH2:17][O:18][CH2:19][CH2:20]3)[c:21]3[nH:22][c:23](-[c:29]4[s:30][cH:31][cH:32][n:33]4)[cH:24][c:25]3[C:26]#[N:28])[cH:11][cH:12]2)[CH2:2][CH2:3]1

Participants

4

Reactant 3

HCID 962WaterHCID 6228DimethylformamideHCID 59331303HCID 59331303, compound

Product 1

HCID 68431249HCID 68431249, compound

Sources & evidence

ORD record
ord-9616b906cdbc4eefae08558ae87fe445
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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