Ethyl isocyanate → HCID 58529496, compound

Reaction equation

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

Participants

Reactant 2

HCID 8022Ethyl isocyanate

HCID 58529902HCID 58529902, compound

Product 1

HCID 58529496HCID 58529496, compound

Sources & evidence

ORD record: ord-c5d0501b47104736be8ace974ebb0454
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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