Toluene → HCID 14502158, compound

HRID 700951Notes

Reaction equation

HRID 700951 reaction equation
[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].[CH3:25][CH:26]1[NH:27][CH2:28][CH2:29][CH2:30]1.[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]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:27]1[CH:26]([CH3:25])[CH2:30][CH2:29][CH2:28]1

Participants

4

Sources & evidence

ORD record
ord-fbcfd2f16649429f98d485fbd6943446
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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