Dimethylformamide → 4-[tert-butyl(dimethyl)silyl]oxy-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]-N-[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyrazol-3-yl]butanamide

HRID 184968Notes

Reaction equation

HRID 184968 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH2:8][CH:9]([C:10](=[O:11])[OH:12])[N:13]1[C:14](=[O:26])[CH:15]=[C:16]([O:18][c:19]2[c:20]([Cl:25])[cH:21][cH:22][cH:23][cH:24]2)[CH2:17]1)([CH3:27])[CH3:28].[CH3:29][C:30]1([CH3:42])[O:31][CH2:32][CH:33]([CH2:35][n:36]2[n:37][c:38]([NH2:41])[cH:39][cH:40]2)[O:34]1.[CH3:70][N:71]([CH3:72])[CH:73]=[O:74].[CH3:75][CH2:76][O:77][C:78](=[O:79])[CH3:80].[P-:43]([F:44])([F:45])([F:46])([F:47])([F:48])[F:49].[n:50]1([O:51][P+:52]([N:53]([CH3:54])[CH3:55])([N:56]([CH3:57])[CH3:58])[N:59]([CH3:60])[CH3:61])[c:62]2[cH:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH2:8][CH:9]([C:10](=[O:11])[NH:41][c:38]1[n:37][n:36]([CH2:35][CH:33]2[CH2:32][O:31][C:30]([CH3:29])([CH3:42])[O:34]2)[cH:40][cH:39]1)[N:13]1[C:14](=[O:26])[CH:15]=[C:16]([O:18][c:19]2[c:20]([Cl:25])[cH:21][cH:22][cH:23][cH:24]2)[CH2:17]1)([CH3:27])[CH3:28]

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 579191601-(2,2-Dimethyl-[1,3]dioxolan-4-ylmethyl)-1H-pyrazol-3-ylamineHCID 675042174-[tert-butyl(dimethyl)silyl]oxy-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]butanoic acid

Product 1

HCID 675037774-[tert-butyl(dimethyl)silyl]oxy-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]-N-[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyrazol-3-yl]butanamide

Sources & evidence

ORD record
ord-4a53cf0116f443b28c290ed3b7f70675
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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