Ethyl Acetate → HCID 178491731, compound

HRID 319544Notes

Reaction equation

HRID 319544 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][S:8][C:9]([CH2:10][C:11]#[N:12])=[NH:13])[cH:14][cH:15]1.[CH3:28][CH2:29][O:30][C:31](=[O:32])[CH3:33].[O:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[C:23](=[O:24])[N:25]=[C:26]=[S:27]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][S:8][C:9]([C:10]([C:11]#[N:12])=[C:26]([NH:25][C:23]([O:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)=[O:24])[SH:27])=[NH:13])[cH:14][cH:15]1

Participants

4

Sources & evidence

ORD record
ord-6020a9be53214ec28bb23ee277f4bc5f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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