Benzene → HCID 76834795, compound

HRID 1220608Notes

Reaction equation

HRID 1220608 reaction equation
[C:34]([CH:35]=[P:36]([CH2:37][CH2:38][CH2:39][CH3:40])([CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH2:47][CH3:48])#[N:49].[CH2:1]([CH:2]=[CH2:3])[C:4]1([CH3:30])[C:5](=[O:29])[N:6]([CH:24]([CH2:25][OH:26])[CH2:27][CH3:28])[CH:7]([c:17]2[n:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:8]([c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[CH2:9]1.[CH2:31]([CH3:32])[SH:33].[Cl:56][CH2:57][Cl:58].[cH:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:1]([CH:2]=[CH2:3])[C:4]1([CH3:30])[C:5](=[O:29])[N:6]([CH:24]([CH2:25][S:33][CH2:31][CH3:32])[CH2:27][CH3:28])[CH:7]([c:17]2[n:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:8]([c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[CH2:9]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 6343EthanethiolHCID 6344DichloromethaneHCID 4622928CyanomethylenetributylphosphoraneHCID 76834612HCID 76834612, compound

Product 1

HCID 76834795HCID 76834795, compound

Sources & evidence

ORD record
ord-5b3a4d57f0ee4e24baf2518299a4e137
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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