Acetate → HCID 58015047, compound

HRID 670559Notes

Reaction equation

HRID 670559 reaction equation
[C:34](=[O:35])([O-:36])[O-:37].[C:40]([O-:41])(=[O:42])[CH3:43].[C:45]([O-:46])(=[O:47])[CH3:48].[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:21]1)[N:7]([CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20]1)[CH2:8][C:9]([F:14])([F:15])[C:10](=[O:13])[N:11]2[CH3:12].[Cs+:38].[Cs+:39].[NH2:22][c:23]1[cH:24][c:25]([F:33])[c:26]([C:27](=[O:28])[OH:29])[cH:30][c:31]1[F:32].[O:49]1[CH2:50][CH2:51][O:52][CH2:53][CH2:54]1.[Pd+2:44]>>[c:2]1([NH:22][c:23]2[cH:24][c:25]([F:33])[c:26]([C:27](=[O:28])[OH:29])[cH:30][c:31]2[F:32])[n:3][cH:4][c:5]2[c:6]([n:21]1)[N:7]([CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20]1)[CH2:8][C:9]([F:14])([F:15])[C:10](=[O:13])[N:11]2[CH3:12]

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 201514774-Amino-2,5-difluorobenzoic acidHCID 579555742-Chloro-9-cyclopentyl-7,7-difluoro-5-methyl-8,9-dihydro-5H-pyrimido[4,5-B][1,4]diazepin-6(7H)-one

Product 1

HCID 58015047HCID 58015047, compound

Sources & evidence

ORD record
ord-a5a65e1471b4453cbce5853b5924ce58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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