Chloroform → HCID 178430949, compound

HRID 691049Notes

Reaction equation

HRID 691049 reaction equation
[CH:54]([N:55]([CH2:56][CH3:57])[CH:58]([CH3:59])[CH3:60])([CH3:61])[CH3:62].[CH:63]([Cl:64])([Cl:65])[Cl:66].[Cl:1][c:2]1[c:3](-[c:10]2[c:11]([CH3:16])[cH:12][n:13][n:14]2[CH3:15])[cH:4][c:5]([C:7](=[O:8])[OH:9])[s:6]1.[F:40][c:41]1[cH:42][cH:43][cH:44][c:45]([F:46])[c:47]1[CH2:48][CH:49]([C:50]([OH:51])=[O:52])[NH2:53].[NH2:17][CH:18]([CH2:19][N:20]1[C:21](=[O:30])[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2[C:28]1=[O:29])[CH2:31][c:32]1[c:33]([F:39])[cH:34][cH:35][c:36]([F:38])[cH:37]1>>[Cl:1][c:2]1[c:3](-[c:10]2[c:11]([CH3:16])[cH:12][n:13][n:14]2[CH3:15])[cH:4][c:5]([C:7](=[O:9])[NH:17][CH:18]([CH2:19][N:20]2[C:21](=[O:30])[c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]3[C:28]2=[O:29])[CH2:31][c:32]2[c:33]([F:39])[cH:34][cH:35][c:36]([F:38])[cH:37]2)[s:6]1

Participants

6

Reactant 5

HCID 6212ChloroformHCID 81531DiisopropylethylamineHCID 27370432,6-DifluorophenylalanineHCID 578264495-chloro-4-(1,4-dimethyl-1H-pyrazol-5-yl)-2-thiophenecarboxylic AcidHCID 178510837HCID 178510837, compound

Product 1

HCID 178430949HCID 178430949, compound

Sources & evidence

ORD record
ord-8f50d1153c7f4b9886bc9acf6b008251
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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