Toluene → HCID 178473006, compound

HRID 112934Notes

Reaction equation

HRID 112934 reaction equation
[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[Cl:21][C:22](=[O:23])[c:24]1[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:35][cH:36]1.[NH2:1][c:2]1[c:3]([S:8][c:9]2[c:10](-[c:16]3[n:17][n:18][n:19][nH:20]3)[c:11]([OH:15])[cH:12][cH:13][cH:14]2)[cH:4][cH:5][cH:6][cH:7]1>>[NH:1]([c:2]1[c:3]([S:8][c:9]2[c:10](-[c:16]3[n:17][n:18][n:19][nH:20]3)[c:11]([OH:15])[cH:12][cH:13][cH:14]2)[cH:4][cH:5][cH:6][cH:7]1)[C:22](=[O:23])[c:24]1[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:35][cH:36]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 20084539HCID 20084539, compoundHCID 178507519HCID 178507519, compound

Product 1

HCID 178473006HCID 178473006, compound

Sources & evidence

ORD record
ord-24f138b1728647039cd3ae302d68a64b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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