Water → HCID 22505984, compound

HRID 2149265Notes

Reaction equation

HRID 2149265 reaction equation
[Br:1][c:2]1[n:3][c:4]([S:13][CH2:14][c:15]2[c:16]([F:22])[c:17]([F:21])[cH:18][cH:19][cH:20]2)[n:5][c:6]2[nH:7][c:8](=[O:12])[cH:9][n:10][c:11]12.[CH3:31][N:32]1[CH2:33][CH2:34][CH2:35][C:36]1=[O:37].[NH2:23][C:24]([CH2:25][OH:26])([CH2:27][OH:28])[CH3:29].[OH2:30]>>[c:2]1([NH:23][C:24]([CH2:25][OH:26])([CH2:27][OH:28])[CH3:29])[n:3][c:4]([S:13][CH2:14][c:15]2[c:16]([F:22])[c:17]([F:21])[cH:18][cH:19][cH:20]2)[n:5][c:6]2[nH:7][c:8](=[O:12])[cH:9][n:10][c:11]12

Participants

5

Reactant 4

HCID 962WaterHCID 15312-Amino-2-methyl-1,3-propanediolHCID 13387N-methyl-2-pyrrolidoneHCID 223200824-bromo-2-[[(2,3-difluorophenyl)methyl]thio]-7(8H)-pteridinone

Product 1

HCID 22505984HCID 22505984, compound

Sources & evidence

ORD record
ord-35deb9d1675748e688e29f38f1f84944
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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