Dimethylformamide → HCID 59596966, compound

HRID 1135324Notes

Reaction equation

HRID 1135324 reaction equation
[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:76][N:77]([CH3:78])[CH:79]=[O:80].[F:26][c:27]1[cH:28][cH:29][c:30]([NH:33][C:34](=[O:35])[C:36]2([C:39](=[O:40])[OH:41])[CH2:37][CH2:38]2)[cH:31][cH:32]1.[P-:49]([F:50])([F:51])([F:52])([F:53])([F:54])[F:55].[c:1]1([O:7][C:8]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]([O:16][c:17]3[c:18]([F:24])[cH:19][c:20]([NH2:23])[cH:21][cH:22]3)[cH:15]2)=[O:25])[cH:2][cH:3][cH:4][cH:5][cH:6]1.[n:56]1([O:57][P+:58]([N:59]([CH3:60])[CH3:61])([N:62]([CH3:63])[CH3:64])[N:65]([CH3:66])[CH3:67])[c:68]2[cH:69][cH:70][cH:71][cH:72][c:73]2[n:74][n:75]1>>[c:1]1([O:7][C:8]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]([O:16][c:17]3[c:18]([F:24])[cH:19][c:20]([NH:23][C:39]([C:36]4([C:34]([NH:33][c:30]5[cH:29][cH:28][c:27]([F:26])[cH:32][cH:31]5)=[O:35])[CH2:37][CH2:38]4)=[O:40])[cH:21][cH:22]3)[cH:15]2)=[O:25])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 210815301-[(4-Fluorophenyl)carbamoyl]cyclopropanecarboxylic AcidHCID 59596928[6-(4-Amino-2-fluorophenoxy)pyrimidin-4-yl]carbamic acid phenyl ester

Product 1

HCID 59596966HCID 59596966, compound

Sources & evidence

ORD record
ord-3eccf7cb11654db3bc4ebf1055334fe3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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