Acetate → HCID 67430661, compound

HRID 1208000Notes

Reaction equation

HRID 1208000 reaction equation
[C:28](=[O:29])([O-:30])[O-:31].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([S:8][CH3:9])[n:7]1.[Cs+:32].[Cs+:33].[NH2:10][c:11]1[cH:12][c:13](-[c:18]2[cH:19][n:20][c:21]([C:23]3([OH:27])[CH2:24][CH2:25][CH2:26]3)[s:22]2)[cH:14][c:15]([CH3:17])[cH:16]1.[O-:41][C:42]([CH3:43])=[O:44].[O-:45][C:46]([CH3:47])=[O:48].[O:34]1[CH2:35][CH2:36][O:37][CH2:38][CH2:39]1.[Pd+2:40]>>[c:2]1([NH:10][c:11]2[cH:12][c:13](-[c:18]3[cH:19][n:20][c:21]([C:23]4([OH:27])[CH2:24][CH2:25][CH2:26]4)[s:22]3)[cH:14][c:15]([CH3:17])[cH:16]2)[n:3][cH:4][cH:5][c:6]([S:8][CH3:9])[n:7]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 164271482-Chloro-4-(methylthio)pyrimidineHCID 584563951-[5-(3-Amino-5-methylphenyl)-2-thiazolyl]cyclobutanol

Product 1

HCID 67430661HCID 67430661, compound

Sources & evidence

ORD record
ord-7745e8e6fe394eb8a0e42d65b9648c7f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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