Dimethyl Sulfoxide → 1-(3-{[2-(4-amino-furazan-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)-4-(4-morpholinyl)-1-butanone

HRID 671480Notes

Reaction equation

HRID 671480 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:6][n:7]1)[n:8][c:9](-[c:13]1[c:14]([NH2:18])[n:15][o:16][n:17]1)[n:10]2[CH2:11][CH3:12].[C:58](=[O:59])([O-:60])[O-:61].[CH3:64][c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1.[CH3:71][O:72][CH2:73][CH2:74][O:75][CH3:76].[CH3:79][S:80]([CH3:81])=[O:82].[Cs+:62].[Cs+:63].[Cu:77][I:78].[NH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[OH:26][c:27]1[cH:28][c:29]([C:33]([CH2:34][CH2:35][CH2:36][N:37]2[CH2:38][CH2:39][O:40][CH2:41][CH2:42]2)=[O:43])[cH:30][cH:31][cH:32]1.[cH:44]1[cH:45][c:46]2[cH:47][cH:48][c:49]3[c:50]([c:51]2[n:52][cH:53]1)[n:54][cH:55][cH:56][cH:57]3>>[c:2]1([O:26][c:27]2[cH:28][c:29]([C:33]([CH2:34][CH2:35][CH2:36][N:37]3[CH2:38][CH2:39][O:40][CH2:41][CH2:42]3)=[O:43])[cH:30][cH:31][cH:32]2)[cH:3][c:4]2[c:5]([cH:6][n:7]1)[n:8][c:9](-[c:13]1[c:14]([NH2:18])[n:15][o:16][n:17]1)[n:10]2[CH2:11][CH3:12]

Participants

11

Reactant 10

HCID 679Dimethyl SulfoxideHCID 1140TolueneHCID 13181,10-PhenanthrolineHCID 6115AnilineHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 104967Cesium cation2×HCID 160998514-(6-Bromo-1-Ethyl-1h-Imidazo[4,5-C]pyridin-2-Yl)-1,2,5-Oxadiazol-3-AmineHCID 688754221-(3-Hydroxyphenyl)-4-(4-morpholinyl)-1-butanone

Product 1

HCID 688703071-(3-{[2-(4-amino-furazan-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)-4-(4-morpholinyl)-1-butanone

Sources & evidence

ORD record
ord-2085699306394d42b232de975077c021
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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