Benzene → HCID 21409276, compound

HRID 159981Notes

Reaction equation

HRID 159981 reaction equation
[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[CH3:1][NH:2][C:3]([O:4][c:5]1[cH:6][c:7]([CH3:12])[c:8]([NH2:11])[cH:9][cH:10]1)=[O:13].[CH3:21][C:22]#[N:23].[CH3:36][CH2:37][OH:38].[O:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[CH:31]([C:32](=[O:33])[Cl:34])[CH3:35].[OH2:39].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH3:1][NH:2][C:3]([O:4][c:5]1[cH:6][c:7]([CH3:12])[c:8]([NH:11][C:32]([CH:31]([O:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH3:35])=[O:33])[cH:9][cH:10]1)=[O:13]

Participants

8

Sources & evidence

ORD record
ord-66fcf2bf13bd44708817e80e261acf40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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