Toluene → HCID 70347305, compound

HRID 319503Notes

Reaction equation

HRID 319503 reaction equation
[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Cl:10][c:11]1[c:12]([O:13][c:14]2[c:15]([NH:24][S:25](=[O:26])(=[O:27])[c:28]3[cH:29][c:30]4[c:31]([cH:36][cH:37]3)[O:32][CH2:33][CH2:34][O:35]4)[n:16][cH:17][n:18][c:19]2[O:20][CH2:21][CH2:22][OH:23])[cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]1.[n:1]1[cH:2][c:3]([N:7]=[C:8]=[O:9])[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3]([NH:7][C:8](=[O:9])[O:23][CH2:22][CH2:21][O:20][c:19]2[c:14]([O:13][c:12]3[c:11]([Cl:10])[cH:41][cH:40][c:39]([O:42][CH3:43])[cH:38]3)[c:15]([NH:24][S:25](=[O:26])(=[O:27])[c:28]3[cH:29][c:30]4[c:31]([cH:36][cH:37]3)[O:32][CH2:33][CH2:34][O:35]4)[n:16][cH:17][n:18]2)[cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 27604933-IsocyanatopyridineHCID 19432661HCID 19432661, compound

Product 1

HCID 70347305HCID 70347305, compound

Sources & evidence

ORD record
ord-d05ba7ad9a48477b81f2bbcf022c3f52
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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