Chloride → [2-Amino-6-(4-methyl-oxazol-2-yl)-3-nitro-pyridin-4-yl]-(6-trifluoromethyl-pyridin-3-ylmethyl)-carbamic acid ethyl ester

HRID 1240598Notes

Reaction equation

HRID 1240598 reaction equation
[CH2:7]([CH3:8])[O:9][C:10]([N:11]([CH2:12][c:13]1[cH:14][n:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]1)[c:23]1[c:24]([N+:31](=[O:32])[O-:33])[c:25]([NH2:30])[n:26][c:27]([Br:29])[cH:28]1)=[O:34].[CH3:1][c:2]1[n:3][cH:4][o:5][cH:6]1.[Cl-:35].[Cl-:36].[Pd+2:75].[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1.[c:56]1([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71][cH:72][cH:73][cH:74]1>>[CH3:1][c:2]1[n:3][c:4](-[c:27]2[n:26][c:25]([NH2:30])[c:24]([N+:31](=[O:32])[O-:33])[c:23]([N:11]([C:10]([O:9][CH2:7][CH3:8])=[O:34])[CH2:12][c:13]3[cH:14][n:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[cH:28]2)[o:5][cH:6]1

Participants

6

Reactant 5

HCID 312Chloride2×HCID 11776Triphenylphosphine2×HCID 696634-MethyloxazoleHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 86614486(2-Amino-6-bromo-3-nitro-pyridin-4-yl)-(6-trifluoromethyl-pyridin-3-ylmethyl)-carbamic acid ethyl ester

Product 1

HCID 67456477[2-Amino-6-(4-methyl-oxazol-2-yl)-3-nitro-pyridin-4-yl]-(6-trifluoromethyl-pyridin-3-ylmethyl)-carbamic acid ethyl ester

Sources & evidence

ORD record
ord-f18e14e54a024a6197d256cd83e68f52
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…