Pyridine → N-[4-chloro-2-fluoro-5-[[2-[3-(furan-2-yl)prop-2-enoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]oxy]phenyl]-3-(2-cyanopropan-2-yl)benzamide

HRID 698455

Reaction equation

HRID 698455 reaction equation
[CH3:74][CH2:75][O:76][C:77](=[O:78])[CH3:79].[NH2:35][c:36]1[s:37][c:38]2[n:39][c:40]([O:45][c:46]3[c:47]([Cl:67])[cH:48][c:49]([F:66])[c:50]([NH:52][C:53]([c:54]4[cH:55][c:56]([C:60]([CH3:61])([CH3:62])[C:63]#[N:64])[cH:57][cH:58][cH:59]4)=[O:65])[cH:51]3)[cH:41][cH:42][c:43]2[n:44]1.[P-:11]([F:12])([F:13])([F:14])([F:15])([F:16])[F:17].[cH:68]1[cH:69][cH:70][n:71][cH:72][cH:73]1.[n:18]1([O:19][C:20]([N:21]([CH3:22])[CH3:23])=[N+:24]([CH3:25])[CH3:26])[c:27]2[n:28][cH:29][cH:30][cH:31][c:32]2[n:33][n:34]1.[o:1]1[c:2]([CH:6]=[CH:7][C:8](=[O:9])[OH:10])[cH:3][cH:4][cH:5]1>>[o:1]1[c:2]([CH:6]=[CH:7][C:8](=[O:10])[NH:35][c:36]2[s:37][c:38]3[n:39][c:40]([O:45][c:46]4[c:47]([Cl:67])[cH:48][c:49]([F:66])[c:50]([NH:52][C:53]([c:54]5[cH:55][c:56]([C:60]([CH3:61])([CH3:62])[C:63]#[N:64])[cH:57][cH:58][cH:59]5)=[O:65])[cH:51]4)[cH:41][cH:42][c:43]3[n:44]2)[cH:3][cH:4][cH:5]1

Participants

7

Reactant 6

HCID 1049PyridineHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 10876Furylacrylic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 86646015N-(5-[(2-Amino[1,3]thiazolo[5,4-b]pyridin-5-yl)oxy]-4-chloro-2-fluorophenyl}-3-(1-cyano-1-methylethyl)benzamide

Product 1

HCID 72310083N-[4-chloro-2-fluoro-5-[[2-[3-(furan-2-yl)prop-2-enoylamino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]oxy]phenyl]-3-(2-cyanopropan-2-yl)benzamide

Sources & evidence

ORD record
ord-00ed7c49d39049a194332a460829cc3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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