Chloride → HCID 69710341, compound

HRID 215168Notes

Reaction equation

HRID 215168 reaction equation
[C:40](=[O:41])([OH:42])[O-:43].[C:54]([O:55][CH2:56][CH3:57])(=[O:58])[CH3:59].[CH3:25][C:26]([O:27][C:28](=[O:29])[CH3:30])=[O:31].[CH3:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[CH3:7][c:8]1[n:9](-[c:18]2[c:19]([CH3:24])[cH:20][cH:21][cH:22][cH:23]2)[c:10](=[O:17])[c:11]2[c:12]([n:13]1)[cH:14][cH:15][s:16]2.[Cl-:45].[Cl-:47].[Na+:44].[O:1]1[CH2:2][CH2:3][O:4][CH2:5][CH2:6]1.[Zn+2:46].[n:32]1[c:33]([CH:38]=[O:39])[cH:34][cH:35][cH:36][cH:37]1>>[CH:7]([c:8]1[n:9](-[c:18]2[c:19]([CH3:24])[cH:20][cH:21][cH:22][cH:23]2)[c:10](=[O:17])[c:11]2[c:12]([n:13]1)[cH:14][cH:15][s:16]2)=[CH:38][c:33]1[n:32][cH:37][cH:36][cH:35][cH:34]1

Participants

11

Reactant 10

HCID 312Chloride2×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 7918Acetic AnhydrideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 142732-PyridinecarboxaldehydeHCID 312751,4-DioxaneHCID 32051Zinc(2+)HCID 9016182-Methyl-3-(2-methylphenyl)thieno[3,2-d]pyrimidin-4(3H)-one

Product 1

HCID 69710341HCID 69710341, compound

Sources & evidence

ORD record
ord-7622d7ca467047e49438eca9ba962138
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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