Acetonitrile → HCID 68700016, compound

Reaction equation

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

Participants

Reactant 4

HCID 6342Acetonitrile

HCID 8471Triethylamine

HCID 12682914-Amino-1-Boc-piperidine

HCID 68406054Methyl 2-chloro-1,3-benzoxazole-7-carboxylate

Product 1

HCID 68700016HCID 68700016, compound

Sources & evidence

ORD record: ord-7046ef402ff94e0c9ca3ea3adbc95184
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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