Ammonium → HCID 136383531, compound

HRID 664338Notes

Reaction equation

HRID 664338 reaction equation
[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[Cl-:39].[F:29][c:30]1[cH:31][c:32]([C:33](=[O:34])[Cl:35])[cH:36][cH:37][cH:38]1.[NH4+:40].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[n:1]1[cH:2][n:3][c:4](-[c:7]2[n:8][c:9]3[n:10]([c:19](=[O:21])[cH:20]2)[CH2:11][CH2:12][C:13]2([NH:14]3)[CH2:15][NH:16][CH2:17][CH2:18]2)[cH:5][cH:6]1>>[n:1]1[cH:2][n:3][c:4](-[c:7]2[n:8][c:9]3[n:10]([c:19](=[O:21])[cH:20]2)[CH2:11][CH2:12][C:13]2([NH:14]3)[CH2:15][N:16]([C:33]([c:32]3[cH:31][c:30]([F:29])[cH:38][cH:37][cH:36]3)=[O:34])[CH2:17][CH2:18]2)[cH:5][cH:6]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312ChlorideHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 743763-Fluorobenzoyl chlorideHCID 136346459HCID 136346459, compound

Product 1

HCID 136383531HCID 136383531, compound

Sources & evidence

ORD record
ord-cb1639e94e2d48ebb4a5690577bf4303
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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