Ammonia → HCID 44545180, compound

HRID 578187Notes

Reaction equation

HRID 578187 reaction equation
[CH3:1][N:2]1[C:6]2[CH:7]=[CH:8][C:9]([C:11]([OH:13])=O)=[CH:10][C:5]=2[N:4]([CH3:14])[C:3]1=[O:15].O[N:17]=[C:18]([NH2:25])[C:19]1[CH:24]=[CH:23][CH:22]=[N:21][CH:20]=1.N>>[CH3:1][N:2]1[C:6]2[CH:7]=[CH:8][C:9]([C:11]3[O:13][N:25]=[C:18]([C:19]4[CH:20]=[N:21][CH:22]=[CH:23][CH:24]=4)[N:17]=3)=[CH:10][C:5]=2[N:4]([CH3:14])[C:3]1=[O:15]

Participants

4

Reactant 3

HCID 222AmmoniaHCID 308113N-HydroxynicotinimidamideHCID 6522241,3-Dimethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid

Product 1

HCID 44545180HCID 44545180, compound

Procedure

The title compound was prepared according to Method C using 1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid (Matrix) and N′-hydroxynicotinimidamide (Tyger). 1H NMR (300 MHz, CD3OD) δ 3.49 (s, 3H), 3.53 (s, 3H), 7.36 (d, J=8.3 Hz, 1H), 7.64 (ddd, J=8.0, 5.1, 0.8 Hz, 1H), 7.98 (d, J=1.6 Hz, 1H), 8.08 (dd, J=8.3, 1.6 Hz, 1H), 8.55 (dt, J=8.0, 1.9 Hz, 1H), 8.73 (dd, J=4.8, 1.6 Hz, 1H) 9.29 (d, J=1.2 Hz, 1H). MS (DCI/NH3) m/z 308 (M+H)+.

Sources & evidence

ORD record
ord-a471cd29343f4d608a9c9941b8651cda
Source dataset
uspto-grants-2015_05
Patent number
US09040568B2

Reaction notes

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