1-Chloro-4-(4-isothiocyanatophenoxy)benzene → HCID 59464209, compound

HRID 1713781Notes

Reaction equation

HRID 1713781 reaction equation
[NH:1]([C:3](=[O:23])[C:4]([NH:6][C:7]1[CH:8]=[CH:9][C:10]([N:13]2[CH2:18][CH2:17][CH:16]([C:19]([O:21][CH3:22])=[O:20])[CH2:15][CH2:14]2)=[N:11][CH:12]=1)=[O:5])[NH2:2].[Cl:24][C:25]1[CH:30]=[CH:29][C:28]([O:31][C:32]2[CH:37]=[CH:36][C:35]([N:38]=[C:39]=S)=[CH:34][CH:33]=2)=[CH:27][CH:26]=1>>[Cl:24][C:25]1[CH:30]=[CH:29][C:28]([O:31][C:32]2[CH:37]=[CH:36][C:35]([NH:38][C:39]3[O:23][C:3]([C:4]([NH:6][C:7]4[CH:8]=[CH:9][C:10]([N:13]5[CH2:14][CH2:15][CH:16]([C:19]([O:21][CH3:22])=[O:20])[CH2:17][CH2:18]5)=[N:11][CH:12]=4)=[O:5])=[N:1][N:2]=3)=[CH:34][CH:33]=2)=[CH:27][CH:26]=1

Participants

3

Reactant 2

HCID 185373151-Chloro-4-(4-isothiocyanatophenoxy)benzeneHCID 68683563HCID 68683563, compound2×

Product 1

HCID 59464209HCID 59464209, compound

Procedure

Prepared using the procedures described above for Example 631 except starting from methyl 1-(5-{[hydrazino(oxo)acetyl]amino}pyridin-2-yl)piperidine-4-carboxylate (Intermediate 83) and 1-chloro-4-(4-isothiocyanatophenoxy)benzene. 1H NMR δ 1.51-1.61 (m, 2H), 1.86-1.91 (m, 2H), 2.59-2.66 (m, 1H), 2.91-2.98 (m, 2H), 3.63 (s, 3H), 4.14-4.19 (m, 2H), 6.87 (d, 1H), 7.00 (d, 2H), 7.13 (d, 2H), 7.41 (d, 2H), 7.64 (d, 2H), 7.90 (d, 1H), 8.47 (s, 1H), 10.88 (s, 1H), 10.97 (s, 1H); MS m/e MH+ 549.

Workup

  1. customPrepared

Sources & evidence

ORD record
ord-d2f7597b1e3c4dd89bb3c56e3034aed0
Source dataset
uspto-grants-2010_09
Patent number
US07795283B2

Reaction notes

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