Ammonium → HCID 21995275, compound

HRID 2158142Notes

Reaction equation

HRID 2158142 reaction equation
[Br:26][Mg:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[C:46]([c:47]1[cH:48][cH:49][n:50][c:51]([NH:52][c:53]2[cH:54][c:55]([O:56][CH3:57])[c:58]([O:59][CH3:60])[c:61]([O:62][CH3:63])[cH:64]2)[n:65]1)([OH:66])=[O:67].[CH2:75]([O:76][C:77]([Cl:78])=[O:79])[CH:80]([CH3:81])[CH3:82].[CH2:88]1[O:89][CH2:90][CH2:91][CH2:92]1.[CH3:1][O:2][N:3]([C:4](=[O:5])[c:6]1[n:7][c:8]([NH:12][c:13]2[cH:14][c:15]([O:23][CH3:24])[c:16]([O:21][CH3:22])[c:17]([O:19][CH3:20])[cH:18]2)[n:9][cH:10][cH:11]1)[CH3:25].[CH3:68][CH2:69][N:70]([CH2:71][CH3:72])[CH2:73][CH3:74].[CH3:84][NH:85][O:86][CH3:87].[Cl-:34].[Cl:93][CH2:94][Cl:95].[ClH:45].[ClH:83].[NH4+:35].[n:36]1[cH:37][cH:38][c:39]([C:40]([NH2:41])=[O:42])[n:43][cH:44]1>>[C:4](=[O:5])([c:6]1[n:7][c:8]([NH:12][c:13]2[cH:14][c:15]([O:23][CH3:24])[c:16]([O:21][CH3:22])[c:17]([O:19][CH3:20])[cH:18]2)[n:9][cH:10][cH:11]1)[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1

Participants

13

Reactant 12

HCID 223AmmoniumHCID 312ChlorideHCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 14232N,O-DimethylhydroxylamineHCID 62365Isobutyl chloroformateHCID 17861762Pyrimidine-4-carboxamideHCID 21995247HCID 21995247, compoundHCID 21995321HCID 21995321, compoundHCID 178418255HCID 178418255, compound

Product 1

HCID 21995275HCID 21995275, compound

Sources & evidence

ORD record
ord-9a37682511a64eb6a1941d5a86e611ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…