Chloroacetyl chloride → HCID 12392971, compound

Reaction equation

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

Participants

Reactant 3

HCID 6577Chloroacetyl chloride

HCID 8471Triethylamine

HCID 1000063(2H)-Isoquinolinone, 1,4-dihydro-1-(4-aminophenyl)-4-(1-methylethyl)-

Product 1

HCID 12392971HCID 12392971, compound

Sources & evidence

ORD record: ord-8e494a1f494b470a8f49bcbb154052ef
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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