Benzene → HCID 19425226, compound

HRID 308715Notes

Reaction equation

HRID 308715 reaction equation
[CH2:27]([CH:28]([CH3:29])[CH3:30])[NH2:31].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[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:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[F:1][c:2]1[c:3]([NH:16][C:20]([C:19]2=[C:18]([C:17](=[O:26])[NH:31][CH2:27][CH:28]([CH3:29])[CH3:30])[CH2:25][CH2:24][CH2:23][CH2:22]2)=[O:21])[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 6558IsobutylamineHCID 8471TriethylamineHCID 15279392HCID 15279392, compound

Product 1

HCID 19425226HCID 19425226, compound

Sources & evidence

ORD record
ord-806750ab5b484d2784c9d08f307e4f1d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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