Toluene → HCID 14502142, compound

HRID 668520Notes

Reaction equation

HRID 668520 reaction equation
[CH2:25]1[CH2:26][CH2:27][NH:28][CH2:29]1.[CH3:1][S:2]([O:3][CH2:6][CH:7]([CH3:8])[N:9]1[c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[S:16][c:17]2[cH:18][cH:19][c:20]([C:23]#[N:24])[cH:21][c:22]21)(=[O:4])=[O:5].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH2:6]([CH:7]([CH3:8])[N:9]1[c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[S:16][c:17]2[cH:18][cH:19][c:20]([C:23]#[N:24])[cH:21][c:22]21)[N:28]1[CH2:27][CH2:26][CH2:25][CH2:29]1

Participants

4

Sources & evidence

ORD record
ord-c3d4f16c656c435b801fc3de74d7e1a0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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