HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Sodium Ion → Diethyl {2-[4-({[2-[(tert-butoxycarbonyl)amino]-5-(2-thienyl)phenyl]amino}carbonyl)phenyl]-1-cyanoethyl}phosphonate

HRID 956579
Notes
Print preview

Reaction equation

HRID 956579 reaction equation
[Br:14][CH2:15][c:16]1[cH:17][cH:18][c:19]([C:20](=[O:21])[NH:22][c:23]2[c:24]([NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[cH:25][cH:26][c:27](-[c:29]3[s:30][cH:31][cH:32][cH:33]3)[cH:28]2)[cH:42][cH:43]1.[C:1](#[N:2])[CH2:3][P:4]([O:5][CH2:6][CH3:7])([O:8][CH2:9][CH3:10])=[O:11].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[H-:12].[Na+:13]>>[C:1](#[N:2])[CH:3]([P:4]([O:5][CH2:6][CH3:7])([O:8][CH2:9][CH3:10])=[O:11])[CH2:15][c:16]1[cH:17][cH:18][c:19]([C:20](=[O:21])[NH:22][c:23]2[c:24]([NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[cH:25][cH:26][c:27](-[c:29]3[s:30][cH:31][cH:32][cH:33]3)[cH:28]2)[cH:42][cH:43]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 923Sodium IonHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 75676Diethyl (cyanomethyl)phosphonateHCID 166653HydrideHCID 57925962Tert-butyl [2-{[4-(bromomethyl)benzoyl]amino}-4-(2-thienyl)phenyl]carbamate

Product 1

HCID 57925835
Diethyl {2-[4-({[2-[(tert-butoxycarbonyl)amino]-5-(2-thienyl)phenyl]amino}carbonyl)phenyl]-1-cyanoethyl}phosphonate

Sources & evidence

ORD record
ord-989841b17b8540cfa29af05438502d60
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes