(2-Methoxy-phenyl)-acetyl isothiocyanate → N-(3-Fluoro-4-(2-(1-(2-methoxyethyl)-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-(2-methoxyphenyl)acetamide
반응식
[CH2:1]([N:3]1[C:7](C)=[C:6]([C:9]2[S:17][C:16]3[C:11](=[N:12][CH:13]=[CH:14][C:15]=3[O:18][C:19]3[CH:24]=[CH:23][C:22]([NH:25][C:26]([NH:28][C:29](=[O:39])[CH2:30][C:31]4[CH:36]=[CH:35][CH:34]=[CH:33][C:32]=4[O:37][CH3:38])=[S:27])=[CH:21][C:20]=3[F:40])[CH:10]=2)[N:5]=[CH:4]1)[CH3:2].FC1C=C(N)C=C[C:47]=1[O:48]C1C=CN=C2C=C(C3N=CN(CCOC)C=3)SC=12.COC1C=CC=CC=1CC(N=C=S)=O>>[F:40][C:20]1[CH:21]=[C:22]([NH:25][C:26]([NH:28][C:29](=[O:39])[CH2:30][C:31]2[CH:36]=[CH:35][CH:34]=[CH:33][C:32]=2[O:37][CH3:38])=[S:27])[CH:23]=[CH:24][C:19]=1[O:18][C:15]1[CH:14]=[CH:13][N:12]=[C:11]2[CH:10]=[C:9]([C:6]3[N:5]=[CH:4][N:3]([CH2:1][CH2:2][O:48][CH3:47])[CH:7]=3)[S:17][C:16]=12참가 물질
4
반응물 3
생성물 1
실험 절차
Following the procedure described above for the compound 90 (scheme 17) but replacing the amine 89 with the amine 95 and using 2-(2-methoxyphenyl)acetyl isothiocyanate instead of 2-phenylacetyl isothiocyanate, title compound 96 was obtained as a beige solid (6 mg, 17% yield). 1H NMR (400 MHz, DMSO-d6) δ (ppm) 12.57 (1H, s), 11.77 (1H, s), 8.53 (1H, d, J=5.48 Hz), 8.08 (1H, d, J=12.03 Hz), 8.02 (1H, s), 7.91 (1H, s), 7.76 (1H, s), 7.59-7.52 (2H, m), 7.28-7.21 (2H, m), 6.98 (1H, d, J=8.22 Hz), 6.91 (1H, d, J=7.44 Hz), 6.71 (1H, d, J=5.67 Hz), 4.21 (2H, t, J=4.89 Hz), 3.80 (2H, s), 3.77 (3H, s), 3.65 (2H, t, J=4.89 Hz), 3.26 (3H, s). MS (m/z) 592.1 (M+H).
출처 및 근거
- ORD 기록
- ord-ba08ad45f065463888c2f92bb83c3dd7
- 출처 데이터셋
- uspto-grants-2010_09
- 특허 번호
- US07790729B2
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