Dimethylformamide → HCID 67343374, compound

HRID 1566569Notes

Reaction equation

HRID 1566569 reaction equation
[CH:1]1([CH2:4][C:5](=[O:6])[OH:7])[CH2:2][CH2:3]1.[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[O:84]=[CH:85][N:86]([CH3:87])[CH3:88].[P-:8]([F:9])([F:10])([F:11])([F:12])([F:13])[F:14].[cH:41]1[cH:42][cH:43][cH:44][c:45]2[c:53]1[CH:52]([CH2:54][O:55][C:56](=[O:57])[N:58]1[CH2:59][CH:60]([NH:64][c:65]3[c:66]4[c:67]([n:68][cH:69][c:70]3[NH2:71])[n:72]([S:75](=[O:76])(=[O:77])[c:78]3[cH:79][cH:80][cH:81][cH:82][cH:83]3)[cH:73][cH:74]4)[CH2:61][CH2:62][CH2:63]1)[c:51]1[c:46]-2[cH:47][cH:48][cH:49][cH:50]1.[n:15]1([O:16][C:17]([N:18]([CH3:19])[CH3:20])=[N+:21]([CH3:22])[CH3:23])[c:24]2[n:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1>>[CH:1]1([CH2:4][C:5](=[O:7])[NH:71][c:70]2[c:65]([NH:64][CH:60]3[CH2:59][N:58]([C:56]([O:55][CH2:54][CH:52]4[c:51]5[c:46]([cH:47][cH:48][cH:49][cH:50]5)-[c:45]5[cH:44][cH:43][cH:42][cH:41][c:53]54)=[O:57])[CH2:63][CH2:62][CH2:61]3)[c:66]3[c:67]([n:68][cH:69]2)[n:72]([S:75](=[O:76])(=[O:77])[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[cH:73][cH:74]3)[CH2:2][CH2:3]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 138440Cyclopropaneacetic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 67346331HCID 67346331, compound

Product 1

HCID 67343374HCID 67343374, compound

Sources & evidence

ORD record
ord-eaae3512099b43a4b5de04795ce9b4ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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