Dimethylformamide → HCID 178428454, compound

HRID 205774Notes

Reaction equation

HRID 205774 reaction equation
[C:1](#[N:2])[C:3]1=[C:4]([CH3:36])[N:5]([c:26]2[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]2)[C:6](=[O:25])[N:7]([CH2:21][C:22](=[O:23])[OH:24])[CH:8]1[c:9]1[c:10]([S:17](=[O:18])(=[O:19])[CH3:20])[cH:11][c:12]([C:15]#[N:16])[cH:13][cH:14]1.[CH:68]([N:69]([CH2:70][CH3:71])[CH:72]([CH3:73])[CH3:74])([CH3:75])[CH3:76].[O:77]=[CH:78][N:79]([CH3:80])[CH3:81].[OH:61][CH:62]1[CH2:63][CH2:64][NH:65][CH2:66][CH2:67]1.[P-:37]([F:38])([F:39])([F:40])([F:41])([F:42])[F:43].[n:44]1([O:45][C:46]([N:47]([CH3:48])[CH3:49])=[N+:50]([CH3:51])[CH3:52])[c:53]2[n:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1>>[C:1](#[N:2])[C:3]1=[C:4]([CH3:36])[N:5]([c:26]2[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]2)[C:6](=[O:25])[N:7]([CH2:21][C:22](=[O:24])[N:65]2[CH2:64][CH2:63][CH:62]([OH:61])[CH2:67][CH2:66]2)[CH:8]1[c:9]1[c:10]([S:17](=[O:18])(=[O:19])[CH3:20])[cH:11][c:12]([C:15]#[N:16])[cH:13][cH:14]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 79341Piperidin-4-olHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178428456HCID 178428456, compound

Product 1

HCID 178428454HCID 178428454, compound

Sources & evidence

ORD record
ord-ececf1419653460986d2891a33f9ff92
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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