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

Water → 3-[4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl]-9-thia-3-azabicyclo[3.3.1]nonane-2,4-dione

HRID 1135445
Notes
Print preview

Reaction equation

HRID 1135445 reaction equation
[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[NH2:12][CH2:13][CH2:14][CH2:15][CH2:16][N:17]1[CH2:18][CH2:19][N:20]([c:23]2[n:24][cH:25][cH:26][cH:27][n:28]2)[CH2:21][CH2:22]1.[OH2:36].[S:1]1[CH:2]2[CH2:3][CH2:4][CH2:5][CH:6]1[C:7](=[O:8])[O:9][C:10]2=[O:11]>>[S:1]1[CH:2]2[CH2:3][CH2:4][CH2:5][CH:6]1[C:7](=[O:9])[N:12]([CH2:13][CH2:14][CH2:15][CH2:16][N:17]1[CH2:18][CH2:19][N:20]([c:23]3[n:24][cH:25][cH:26][cH:27][n:28]3)[CH2:21][CH2:22]1)[C:10]2=[O:11]
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 962WaterHCID 1140TolueneHCID 128407054-(2-Pyrimidinyl)-1-piperazinebutanamineHCID 54010570Tetrahydrothiopyran-2,6-dicarboxylic anhydride

Product 1

HCID 141563613-[4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl]-9-thia-3-azabicyclo[3.3.1]nonane-2,4-dione

Sources & evidence

ORD record
ord-6def8cb1cd22468f9a16d12a860b0c11
On this pageParticipantsSources & evidenceReaction notes
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…