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

Pyridine → 4-[3-(3-methoxypropyl)piperazin-1-yl]-2-propan-2-yl-10H-[1,3]thiazolo[5,4-b][1,5]benzodiazepine

HRID 125917
Notes
Print preview

Reaction equation

HRID 125917 reaction equation
[CH3:28][O:29][CH2:30][CH2:31][CH2:32][CH:33]1[NH:34][CH2:35][CH2:36][NH:37][CH2:38]1.[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6]2[c:12]([s:13]1)[NH:11][c:10]1[c:9]([cH:17][cH:16][cH:15][cH:14]1)[NH:8][C:7]2=[S:18].[Cl:45][CH2:46][Cl:47].[S:19]([O:20][CH3:21])([C:22]([F:23])([F:24])[F:25])(=[O:26])=[O:27].[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6]2[c:12]([s:13]1)[NH:11][c:10]1[c:9]([cH:17][cH:16][cH:15][cH:14]1)[N:8]=[C:7]2[N:37]1[CH2:36][CH2:35][NH:34][CH:33]([CH2:32][CH2:31][CH2:30][O:29][CH3:28])[CH2:38]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 1049PyridineHCID 6344DichloromethaneHCID 9526Methyl triflateHCID 210934792-Isopropyl-4,9-dihydro-3-thia-1,4,9-triazabenzo[f]azulene-10-thioneHCID 534058972-(3-Methoxypropyl)piperazine

Product 1

HCID 136384292
4-[3-(3-methoxypropyl)piperazin-1-yl]-2-propan-2-yl-10H-[1,3]thiazolo[5,4-b][1,5]benzodiazepine

Sources & evidence

ORD record
ord-9f913094a1db4112ae836b08978dd08f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes