Dichloromethane → HCID 178429879, compound

HRID 310756Notes

Reaction equation

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

Participants

Reactant 4

HCID 6344Dichloromethane

HCID 8857Ethyl Acetate

HCID 811841,8-Diazabicyclo(5.4.0)undec-7-ene

HCID 666744343-{5-[4-(4-Bromo-2-fluorophenylamino)-1,5-dimethyl-6-oxo-1,6-dihydro-pyridin-3-yl]-tetrazol-1-yl}-propionitrile

Product 1

HCID 178429879HCID 178429879, compound

Sources & evidence

ORD record: ord-ce3f4361595d4a429bd73af94d9abc5b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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