Benzene → NSC645043

HRID 199139Notes

Reaction equation

HRID 199139 reaction equation
[CH3:21][I:22].[H-:19].[Na+:20].[c:1]1([C:7]2=[N:8][c:9]3[c:10]([cH:15][cH:16][cH:17][cH:18]3)[NH:11][C:12](=[S:14])[CH2:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[c:1]1([C:7]2=[N:8][c:9]3[c:10]([cH:15][cH:16][cH:17][cH:18]3)[N:11]=[C:12]([S:14][CH3:21])[CH2:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 923Sodium ionHCID 6328Methyl iodideHCID 166653HydrideHCID 30329842H-1,5-Benzodiazepine-2-thione, 1,3-dihydro-4-phenyl-

Product 1

HCID 371096NSC645043

Sources & evidence

ORD record
ord-42d0ebfecc85422f836bcf61e5ffbf3b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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