Ammonium → HCID 11582641, compound

HRID 169621Notes

Reaction equation

HRID 169621 reaction equation
[Br-:32].[CH2:35]([O:36][CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH3:43].[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:33][Mg+:34].[Cl-:44].[F:1][c:2]1[cH:3][c:4]([C:8]([C:9]#[N:10])([CH3:11])[N:12]2[CH2:13][CH2:14][CH:15]([NH:18][c:19]3[c:20]4[c:21]([n:22][cH:23][n:24]3)[s:25][c:26]3[c:27]4[CH2:28][CH2:29][CH2:30][CH2:31]3)[CH2:16][CH2:17]2)[cH:5][cH:6][cH:7]1.[NH4+:45]>>[F:1][c:2]1[cH:3][c:4]([C:8]([CH3:9])([CH3:11])[N:12]2[CH2:13][CH2:14][CH:15]([NH:18][c:19]3[c:20]4[c:21]([n:22][cH:23][n:24]3)[s:25][c:26]3[c:27]4[CH2:28][CH2:29][CH2:30][CH2:31]3)[CH2:16][CH2:17]2)[cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 8028TetrahydrofuranHCID 8909Butyl etherHCID 11662049HCID 11662049, compoundHCID 178477777HCID 178477777, compound

Product 1

HCID 11582641HCID 11582641, compound

Sources & evidence

ORD record
ord-4349f2f5e7b94bf889a11e3e668064eb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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