Sodium ion → Tert-butyl tert-butyl(2-((2-chlorophenyl)(methyl)carbamoyl)-4,5-dihydropyrido[4,3-b]thieno[2,3-d]oxepin-8-yl)carbamate

HRID 2310684

Reaction equation

HRID 2310684 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]([C:6]([O:7][C:8]([CH3:9])([CH3:10])[CH3:11])=[O:12])[c:13]1[cH:14][c:15]2[c:21]([cH:22][n:23]1)-[c:20]1[c:19]([cH:26][c:25]([C:27]([NH:28][c:29]3[c:30]([Cl:35])[cH:31][cH:32][cH:33][cH:34]3)=[O:36])[s:24]1)[CH2:18][CH2:17][O:16]2.[CH3:37][I:38].[H-:39].[Na+:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]([C:6]([O:7][C:8]([CH3:9])([CH3:10])[CH3:11])=[O:12])[c:13]1[cH:14][c:15]2[c:21]([cH:22][n:23]1)-[c:20]1[c:19]([cH:26][c:25]([C:27]([N:28]([c:29]3[c:30]([Cl:35])[cH:31][cH:32][cH:33][cH:34]3)[CH3:37])=[O:36])[s:24]1)[CH2:18][CH2:17][O:16]2

Participants

5

Reactant 4

HCID 923Sodium ionHCID 6328Methyl iodideHCID 166653HydrideHCID 57900446tert-Butyl tert-butyl(2-(2-chlorophenylcarbamoyl)-4,5-dihydropyrido[4,3-b]thieno[2,3-d]oxepin-8-yl)carbamate

Product 1

HCID 57900249Tert-butyl tert-butyl(2-((2-chlorophenyl)(methyl)carbamoyl)-4,5-dihydropyrido[4,3-b]thieno[2,3-d]oxepin-8-yl)carbamate

Sources & evidence

ORD record
ord-bcafda18acf54def9e95417952ec0cfd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Linked notes

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