HCID 67095917, compound → HCID 44194154, compound

HRID 2076088Notes

Reaction equation

HRID 2076088 reaction equation
CN(C)/[CH:3]=[C:4]1\[C:5](=O)[CH:6]([C:10]2[CH:15]=[C:14]([F:16])[C:13]([F:17])=[C:12]([F:18])[CH:11]=2)[CH2:7][CH2:8][CH2:9]\1.[N+]([O-])(O)=O.[N+]([O-])(O)=O.[CH3:29][O:30][C:31]1[CH:32]=[C:33]([NH:43][C:44]([NH2:46])=[NH:45])[CH:34]=[CH:35][C:36]=1[N:37]1[CH:41]=[C:40]([CH3:42])[N:39]=[CH:38]1>>[CH3:29][O:30][C:31]1[CH:32]=[C:33]([NH:43][C:44]2[N:46]=[CH:3][C:4]3[CH2:9][CH2:8][CH2:7][CH:6]([C:10]4[CH:11]=[C:12]([F:18])[C:13]([F:17])=[C:14]([F:16])[CH:15]=4)[C:5]=3[N:45]=2)[CH:34]=[CH:35][C:36]=1[N:37]1[CH:41]=[C:40]([CH3:42])[N:39]=[CH:38]1

Participants

3

Reactant 2

HCID 67095917HCID 67095917, compoundHCID 178493228HCID 178493228, compound

Product 1

HCID 44194154HCID 44194154, compound

Procedure

The title compound was prepared from crude 2-[1-dimethylamino-meth-(Z)-ylidene]-6-(3,4,5-trifluoro-phenyl)-cyclohexanone (120 mg, 0.42 mmol) and N-[3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-guanidine dinitrate (131 mg, 0.35 mmol) using in analogous manner the procedure described in example 45b). Obtained as a yellow solid (64 mg, 64%). MS ISP (m/e): 466.2 (100) [(M+H)+]. 1H NMR (DMSO-D6, 300 MHz): δ (ppm)=9.57 (s, 1H), 8.36 (s, 1H), 7.60 (m, 2H), 7.01-7.18 (m, 4H), 6.98 (s, 1H), 4.18 (m, 1H), 3.55 (s, 3H), 2.73 (m, 2H), 2.13 (s, 3H), 1.70-2.20 (m, 4H).

Sources & evidence

ORD record
ord-5e7b6d3460804dec8359df7122b444f4
Source dataset
uspto-grants-2011_04
Patent number
US07923450B2

Reaction notes

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