HCID 22291738, compound → HCID 22291719, compound

HRID 968122Notes

Reaction equation

HRID 968122 reaction equation
[Cl-].[C:2]([C:5]1[N:10]=[C:9]([S:11][CH2:12][CH2:13][NH+:14]([CH3:16])[CH3:15])[CH:8]=[CH:7][C:6]=1[Cl:17])([OH:4])=O.[NH2:18][C:19]1[CH:41]=[CH:40][C:22]2[CH2:23][CH2:24][C:25]3[C:26]([C:37]([NH2:39])=[O:38])=[N:27][N:28]([C:30]4[CH:35]=[CH:34][C:33]([F:36])=[CH:32][CH:31]=4)[C:29]=3[C:21]=2[CH:20]=1>>[Cl:17][C:6]1[C:5]([C:2]([NH:18][C:19]2[CH:41]=[CH:40][C:22]3[CH2:23][CH2:24][C:25]4[C:26]([C:37]([NH2:39])=[O:38])=[N:27][N:28]([C:30]5[CH:31]=[CH:32][C:33]([F:36])=[CH:34][CH:35]=5)[C:29]=4[C:21]=3[CH:20]=2)=[O:4])=[N:10][C:9]([S:11][CH2:12][CH2:13][N:14]([CH3:16])[CH3:15])=[CH:8][CH:7]=1

Participants

3

Reactant 2

HCID 22291738HCID 22291738, compoundHCID 22291910HCID 22291910, compound

Product 1

HCID 22291719HCID 22291719, compound

Procedure

The title compound was synthesized from 0.355 g of the title compound of Step 1 and the title compound of Example 244 (0.32 g) by the same procedure used in Example 255. The title compound is a white solid (0.49 g, 87%). Its structure was confirmed by 1H NMR and LC/MS: 1H NMR (CD3CN): δ 2.18 (s, 6H), 2.57 (m, 2H), 2.85 (m, 4H), 3.00 (m, 4H), 3.26 (m, 2H), 5.88 (s, 1H), 6.94 (d, 1H), 7.27-7.38 (m, 5H), 7.47-7.62 (m, 3H), 7.69 (d, 1H, J=9 Hz), 9.40 (s, 1H). ESI mass spectrum for C28H27ClFN6O2S+: 565 (M+1).

Sources & evidence

ORD record
ord-800b87590f304acba76ad18733379389
Source dataset
uspto-grants-2005_10
Patent number
US06956052B2

Reaction notes

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