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Hydrochloric Acid → 6-(2,4-Diamino-pyrimidin-5-ylmethyl)-1-methyl-1H-indol-4-ol

HRID 125183
Notes
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Reaction equation

HRID 125183 reaction equation
[CH3:1][n:2]1[cH:3][cH:4][c:5]2[c:6]([O:20][CH2:21][O:22][CH2:23][CH2:24][Si:25]([CH3:26])([CH3:27])[CH3:28])[cH:7][c:8]([CH2:11][c:12]3[c:13]([NH2:19])[n:14][c:15]([NH2:18])[n:16][cH:17]3)[cH:9][c:10]12.[CH3:29][n:30]1[c:31]2[c:32]([c:33]([O:34][CH2:35][O:36][CH2:37][CH2:38][Si:39]([CH3:40])([CH3:41])[CH3:42])[cH:43][c:44]([CH:45]=[O:46])[cH:47]2)[cH:48][cH:49]1.[CH3:66][C:67]([OH:68])([CH3:69])[CH3:70].[CH3:71][S:72]([CH3:73])=[O:74].[CH3:75][CH2:76][O:77][C:78](=[O:79])[CH3:80].[CH3:81][CH2:82][OH:83].[ClH:61].[NH2:62][C:63]([NH2:64])=[NH:65].[NH:50]([CH2:51][CH2:52][C:53]#[N:54])[c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1>>[CH3:1][n:2]1[cH:3][cH:4][c:5]2[c:6]([OH:20])[cH:7][c:8]([CH2:11][c:12]3[c:13]([NH2:19])[n:14][c:15]([NH2:18])[n:16][cH:17]3)[cH:9][c:10]12
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 702EthanolHCID 3520GuanidineHCID 6386tert-ButanolHCID 8857Ethyl AcetateHCID 141003-Anilinopropionitrile
HCID 22742876
1-methyl-4-(2-trimethylsilanyl-ethoxymethoxy)-1H-indole-6-carbaldehyde
HCID 699224535-[1-methyl-4-(2-trimethylsilanyl-ethoxymethoxy)-1H-indol-6-ylmethyl]-pyrimidine-2,4-diamine

Product 1

HCID 227428906-(2,4-Diamino-pyrimidin-5-ylmethyl)-1-methyl-1H-indol-4-ol

Sources & evidence

ORD record
ord-b68af0e7cce842faa0dbc8086a2d467b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes