Ammonia → 8'-Chloro-3',3'-dimethyl-3',4'-dihydro-2'H-spiro[1,3-dioxane-2,10'-pyrimido[1,2-a]indole]

HRID 1144600Notes

Reaction equation

HRID 1144600 reaction equation
[CH2:23]1[O:24][CH2:25][CH2:26][CH2:27]1.[CH3:28][CH2:29][OH:30].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:6][cH:7]1)[N:8]([CH2:17][C:18]([C:19]#[N:20])([CH3:21])[CH3:22])[C:9](=[O:16])[C:10]21[O:11][CH2:12][CH2:13][CH2:14][O:15]1.[NH3:31]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:6][cH:7]1)[N:8]1[C:9](=[N:20][CH2:19][C:18]([CH3:21])([CH3:22])[CH2:17]1)[C:10]21[O:11][CH2:12][CH2:13][CH2:14][O:15]1

Participants

5

Reactant 4

HCID 222AmmoniaHCID 702EthanolHCID 8028TetrahydrofuranHCID 589325223-(5'-Chloro-2'-oxospiro[1,3-dioxane-2,3'-indol]-1'(2'H)-yl)-2,2-dimethylpropanenitrile

Product 1

HCID 589325308'-Chloro-3',3'-dimethyl-3',4'-dihydro-2'H-spiro[1,3-dioxane-2,10'-pyrimido[1,2-a]indole]

Sources & evidence

ORD record
ord-8e33ed8784f74690a56a5a95104f572e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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