Toluene → HCID 86613936, compound

HRID 2340778Notes

Reaction equation

HRID 2340778 reaction equation
[CH3:28][C:29]1=[C:40]([C:41]([O:42][CH2:43][CH3:44])=[O:45])[CH2:39][C:33]([C:34]([O:35][CH2:36][CH3:37])=[O:38])=[C:31]([CH3:32])[NH:30]1.[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][n:7]2[c:8](=[O:25])[cH:9][c:10]([CH:17]=[C:18]3[C:19](=[O:24])[NH:20][C:21](=[O:23])[S:22]3)[c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]23)[cH:26][cH:27]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][n:7]2[c:8](=[O:25])[cH:9][c:10]([CH2:17][CH:18]3[C:19](=[O:24])[NH:20][C:21](=[O:23])[S:22]3)[c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]23)[cH:26][cH:27]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 70849Hantzsch esterHCID 86613934HCID 86613934, compound

Product 1

HCID 86613936HCID 86613936, compound

Sources & evidence

ORD record
ord-427bd9c987a34e70a994a5f99ba65b3a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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