Dimethyl Sulfoxide → 1-methyl-5,10-dihydrobenzo[b]pyrazolo[3,4-e][1,4]diazepin-4(1H)-one

HRID 1564490

Reaction equation

HRID 1564490 reaction equation
[CH2:8]([O:10][C:11](=[O:9])[c:13]1[cH:14][n:15][n:16]([CH3:26])[c:17]1[NH:18][c:19]1[c:20]([NH2:25])[cH:21][cH:22][cH:23][cH:24]1)[CH3:12].[CH3:1][S:2]([CH2-:3])=[O:4].[CH3:27][S:28](=[O:29])[CH3:30].[H-:6].[Na+:5].[Na+:7]>>[O:10]=[C:11]1[c:13]2[cH:14][n:15][n:16]([CH3:26])[c:17]2[NH:18][c:19]2[c:20]([cH:21][cH:22][cH:23][cH:24]2)[NH:25]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 923Sodium ion2×HCID 166653HydrideHCID 3763251MethylsulfinylmethanideHCID 57555331ethyl 5-(2-aminophenylamino)-1-methyl-1H-pyrazole-4-carboxylate

Product 1

HCID 1357360341-methyl-5,10-dihydrobenzo[b]pyrazolo[3,4-e][1,4]diazepin-4(1H)-one

Sources & evidence

ORD record
ord-e36cf6e29ea048b39125e6e1d2c9eaa5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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