tert-Butyl isocyanate → HCID 58980071, compound

HRID 1129829Notes

Reaction equation

HRID 1129829 reaction equation
[C:24]([CH3:25])([CH3:26])([CH3:27])[N:28]=[C:29]=[O:30].[CH2:1]([CH3:2])[n:3]1[n:4][c:5](-[c:17]2[cH:18][cH:19][c:20]([NH2:21])[cH:22][cH:23]2)[c:6](-[c:8]2[c:9]3[c:10]([n:11][cH:12][cH:13]2)[nH:14][cH:15][cH:16]3)[cH:7]1>>[CH2:1]([CH3:2])[n:3]1[n:4][c:5](-[c:17]2[cH:18][cH:19][c:20]([NH:21][C:29]([NH:28][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:30])[cH:22][cH:23]2)[c:6](-[c:8]2[c:9]3[c:10]([n:11][cH:12][cH:13]2)[nH:14][cH:15][cH:16]3)[cH:7]1

Participants

3

Reactant 2

HCID 62412tert-Butyl isocyanateHCID 689998134-[1-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrazol-3-yl]aniline

Product 1

HCID 58980071HCID 58980071, compound

Sources & evidence

ORD record
ord-e0f0bc5c5bb34d6a8acd02ecf7a631e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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