Sodium ion → tert-butyl 4-[[2-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate

HRID 137588

Reaction equation

HRID 137588 reaction equation
[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])=[CH:12][CH2:13]1.[CH3:18][CH2:19][O-:20].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[Cl:21][C:22]([C:23]([Cl:24])=[O:25])=[O:26].[Cl:27][c:28]1[cH:29][cH:30][c:31]([NH:34][C:35]([c:36]2[c:37]([NH2:42])[cH:38][cH:39][cH:40][cH:41]2)=[O:43])[n:32][cH:33]1.[Cl:49][CH2:50][Cl:51].[Na+:17].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[cH:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:16])[NH:42][c:37]2[c:36]([C:35]([NH:34][c:31]3[cH:30][cH:29][c:28]([Cl:27])[cH:33][n:32]3)=[O:43])[cH:41][cH:40][cH:39][cH:38]2)=[CH:12][CH2:13]1

Participants

10

Reactant 9

HCID 923Sodium ionHCID 1049PyridineHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 65578Oxalyl chlorideHCID 1194401-Hydroxyethyl radicalHCID 177817901-((Tert-butoxy)carbonyl)-1,2,3,6-tetrahydropyridine-4-carboxylic acidHCID 219063812-amino-N-(5-chloropyridin-2-yl)benzamide

Product 1

HCID 57080991tert-butyl 4-[[2-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Sources & evidence

ORD record
ord-ab6b6cbfe54348c0b86fd2d0ed39e9b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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