Benzene → HCID 19425283, compound

HRID 2344432Notes

Reaction equation

HRID 2344432 reaction equation
[CH2:27]([CH2:28][CH2:29][CH2:30][CH2:31][CH3:32])[NH2:33].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[F:1][c:2]1[c:3]([N:16]2[C:17](=[O:26])[C:18]3=[C:19]([C:20]2=[O:21])[CH2:22][CH2:23][CH2:24][CH2:25]3)[cH:4][c:5]([O:9][CH:10]2[CH2:11][CH:12]([CH3:15])[CH2:13][CH2:14]2)[c:6]([Cl:8])[cH:7]1.[cH:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[F:1][c:2]1[c:3]([NH:16][C:17]([C:18]2=[C:19]([C:20](=[O:21])[NH:33][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32])[CH2:22][CH2:23][CH2:24][CH2:25]2)=[O:26])[cH:4][c:5]([O:9][CH:10]2[CH2:11][CH:12]([CH3:15])[CH2:13][CH2:14]2)[c:6]([Cl:8])[cH:7]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 8102HexylamineHCID 8471TriethylamineHCID 15279392HCID 15279392, compound

Product 1

HCID 19425283HCID 19425283, compound

Sources & evidence

ORD record
ord-778a4ae5a5bd4d8d8fedbbc04e4bec04
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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