Isopropanol → HCID 46868215, compound

HRID 674970Notes

Reaction equation

[Br:1][c:2]1[c:3]([Cl:12])[c:4]([N+:9](=[O:10])[O-:11])[c:5]([NH2:8])[n:6][cH:7]1.[CH:29]([N:30]([CH:31]([CH3:32])[CH3:33])[CH2:34][CH3:35])([CH3:36])[CH3:37].[CH:38]([OH:39])([CH3:40])[CH3:41].[N:13]1([CH2:19][C:20](=[O:21])[NH:22][c:23]2[cH:24][n:25][cH:26][cH:27][cH:28]2)[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]1>>[Br:1][c:2]1[c:3]([N:16]2[CH2:15][CH2:14][N:13]([CH2:19][C:20](=[O:21])[NH:22][c:23]3[cH:24][n:25][cH:26][cH:27][cH:28]3)[CH2:18][CH2:17]2)[c:4]([N+:9](=[O:10])[O-:11])[c:5]([NH2:8])[n:6][cH:7]1

Participants

Reactant 4

HCID 3776Isopropanol

HCID 81531Diisopropylethylamine

HCID 2737191N-3-Pyridinyl-1-piperazineacetamide

HCID 454802365-Bromo-4-chloro-3-nitropyridin-2-amine

Product 1

HCID 46868215HCID 46868215, compound

Sources & evidence

ORD record: ord-dd5dd91e121d4e0595fd939cbb39ff6b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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