Toluene → HCID 24760089, compound

HRID 2146909Notes

Reaction equation

HRID 2146909 reaction equation
[CH3:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[Cl:1][c:2]1[c:3]([N:11]([CH2:12][C:13](=[O:14])[N:15]([CH2:16][c:17]2[n:18][c:19]([CH3:23])[cH:20][n:21][cH:22]2)[CH2:24][CH3:25])[S:26](=[O:27])(=[O:28])[c:29]2[cH:30][c:31]([O:37][CH3:38])[c:32]([O:35][CH3:36])[cH:33][cH:34]2)[cH:4][c:5]([N:8]([CH3:9])[CH3:10])[cH:6][cH:7]1.[P:39]12(=[S:40])[S:41][P:42]3(=[S:52])[S:43][P:44](=[S:50])([S:45][P:46](=[S:49])([S:47]3)[S:48]1)[S:51]2>>[Cl:1][c:2]1[c:3]([N:11]([CH2:12][C:13]([N:15]([CH2:16][c:17]2[n:18][c:19]([CH3:23])[cH:20][n:21][cH:22]2)[CH2:24][CH3:25])=[S:40])[S:26](=[O:27])(=[O:28])[c:29]2[cH:30][c:31]([O:37][CH3:38])[c:32]([O:35][CH3:36])[cH:33][cH:34]2)[cH:4][c:5]([N:8]([CH3:9])[CH3:10])[cH:6][cH:7]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 14817Phosphorus sulfide (P2S5)HCID 24760021HCID 24760021, compound

Product 1

HCID 24760089HCID 24760089, compound

Sources & evidence

ORD record
ord-1227d5d3b0e4490fb407afdeee6ae7d6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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