Hexahydro-1,4-diazepine → HCID 67240905, compound

HRID 2331372Notes

Reaction equation

HRID 2331372 reaction equation
[Cl:1][c:2]1[cH:3][c:4]([C:28]([F:29])([F:30])[F:31])[c:5]([CH2:6][n:7]2[n:8][cH:9][c:10]3[cH:11][c:12]([CH:16]=[C:17]4[C:18](=[O:25])[N:19]=[C:20]([S:22][CH2:23][CH3:24])[S:21]4)[cH:13][cH:14][c:15]23)[cH:26][cH:27]1.[NH:32]1[CH2:33][CH2:34][NH:35][CH2:36][CH2:37][CH2:38]1>>[Cl:1][c:2]1[cH:3][c:4]([C:28]([F:29])([F:30])[F:31])[c:5]([CH2:6][n:7]2[n:8][cH:9][c:10]3[cH:11][c:12]([CH:16]=[C:17]4[C:18](=[O:25])[N:19]=[C:20]([N:32]5[CH2:33][CH2:34][NH:35][CH2:36][CH2:37][CH2:38]5)[S:21]4)[cH:13][cH:14][c:15]23)[cH:26][cH:27]1

Participants

3

Reactant 2

HCID 68163Hexahydro-1,4-diazepineHCID 672401235-[1-(4-chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-ethylsulfanyl-thiazol-4-one

Product 1

HCID 67240905HCID 67240905, compound

Sources & evidence

ORD record
ord-7d97baf9bbf14fb3b6d730cce5b11b86
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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