Dimethylformamide → HCID 178508771, compound

HRID 688212Notes

Reaction equation

HRID 688212 reaction equation
[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[NH2:1][c:2]1[c:3]([C:10](=[O:11])[N:12]=[C:13]2[NH:14][C:15]3([CH2:16][NH:17]2)[CH2:18][CH2:19][N:20]([C:23](=[O:24])[c:25]2[cH:26][c:27]([S:31](=[O:32])(=[O:33])[NH:34][CH2:35][CH2:36][C:37](=[O:38])[OH:39])[cH:28][cH:29][cH:30]2)[CH2:21][CH2:22]3)[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1.[O:86]=[CH:87][N:88]([CH3:89])[CH3:90].[OH:73][CH2:74][C:75](=[O:76])[N:77]1[CH:78]([C:82]([F:83])([F:84])[F:85])[CH2:79][CH2:80][CH2:81]1.[P-:49]([F:50])([F:51])([F:52])([F:53])([F:54])[F:55].[n:56]1([O:57][C:58]([N:59]([CH3:60])[CH3:61])=[N+:62]([CH3:63])[CH3:64])[c:65]2[n:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[NH2:1][c:2]1[c:3]([C:10](=[O:11])[N:12]=[C:13]2[NH:14][C:15]3([CH2:16][NH:17]2)[CH2:18][CH2:19][N:20]([C:23](=[O:24])[c:25]2[cH:26][c:27]([S:31](=[O:32])(=[O:33])[NH:34][CH2:35][CH2:36][C:37]([O:38][CH2:74][C:75](=[O:76])[N:77]4[CH:78]([C:82]([F:83])([F:84])[F:85])[CH2:79][CH2:80][CH2:81]4)=[O:39])[cH:28][cH:29][cH:30]2)[CH2:21][CH2:22]3)[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 667975172-Hydroxy-1-(2-(trifluoromethyl)pyrrolidin-1-yl)ethanoneHCID 178508769HCID 178508769, compound

Product 1

HCID 178508771HCID 178508771, compound

Sources & evidence

ORD record
ord-cae2a1f9ef2544ec92fd872838aff700
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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