Dimethylformamide → HCID 69030986, compound

HRID 674431Notes

Reaction equation

HRID 674431 reaction equation
[C:51]([CH3:52])([CH3:53])([CH3:54])[O:55][C:56](=[O:57])[N:58]([C:59](=[O:60])[O:61][C:62]([CH3:63])([CH3:64])[CH3:65])[CH2:66][c:67]1[cH:68][c:69]([CH:73]2[CH2:74][CH2:75][NH:76][CH2:77][CH2:78]2)[cH:70][cH:71][cH:72]1.[CH3:79][N:80]([CH3:81])[CH:82]=[O:83].[CH:42]([N:43]([CH:44]([CH3:45])[CH3:46])[CH2:47][CH3:48])([CH3:49])[CH3:50].[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[c:1]1([C:7]#[C:8][c:9]2[cH:10][c:11]([C:15](=[O:16])[OH:17])[cH:12][n:13][cH:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[n:25]1([O:26][C:27]([N:28]([CH3:29])[CH3:30])=[N+:31]([CH3:32])[CH3:33])[c:34]2[n:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[c:1]1([C:7]#[C:8][c:9]2[cH:10][c:11]([C:15](=[O:17])[N:76]3[CH2:75][CH2:74][CH:73]([c:69]4[cH:68][c:67]([CH2:66][N:58]([C:56]([O:55][C:51]([CH3:52])([CH3:53])[CH3:54])=[O:57])[C:59](=[O:60])[O:61][C:62]([CH3:63])([CH3:64])[CH3:65])[cH:72][cH:71][cH:70]4)[CH2:78][CH2:77]3)[cH:12][n:13][cH:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 27792365-(2-Phenyleth-1-Ynyl)Nicotinic AcidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 222661574-[3-(N,N-di-tert-butoxycarbonylaminomethyl)phenyl]piperidine

Product 1

HCID 69030986HCID 69030986, compound

Sources & evidence

ORD record
ord-cd47a97fbe264cb09847ffa7a4af21fd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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