Dichloromethane → HCID 68835639, compound

HRID 285528Notes

Reaction equation

[CH2:37]([CH3:38])[N:39]=[C:40]=[O:41].[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:20]2[cH:21][c:22]([NH:26][CH:27]3[CH2:28][C:29]([CH3:35])([CH3:36])[CH2:30][C:31]([CH3:33])([CH3:34])[CH2:32]3)[cH:23][cH:24][cH:25]2)[c:8]([Br:19])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18].[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[Cl:49][CH2:50][Cl:51]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:20]2[cH:21][c:22]([N:26]([CH:27]3[CH2:28][C:29]([CH3:35])([CH3:36])[CH2:30][C:31]([CH3:33])([CH3:34])[CH2:32]3)[C:40]([NH:39][CH2:37][CH3:38])=[O:41])[cH:23][cH:24][cH:25]2)[c:8]([Br:19])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18]

Participants

Reactant 4

HCID 6344Dichloromethane

HCID 8022Ethyl isocyanate

HCID 8471Triethylamine

HCID 57640842Methyl 4-bromo-3-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-5-[3-[(3,3,5,5-tetramethylcyclohexyl)amino]phenyl]thiophene-2-carboxylate

Product 1

HCID 68835639HCID 68835639, compound

Sources & evidence

ORD record: ord-fc866e625fd44bc089cb3a2c1fef11e1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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