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Benzene, 1-chloro-3-isocyanato- → (S)-methyl 2-(5-(4-(3-(3-chlorophenyl)ureido)phenyl)oxazole-2-carboxamido)-3-methylbutanoate
関与物質
| 役割 | 名称 | HCID | 仕込み量 |
|---|---|---|---|
| 反応物 | Benzene, 1-chloro-3-isocyanato- | HCID 17968 | — |
| 反応物 | Methyl 2-(5-(4-aminophenyl)oxazole-2-carboxamido)-3-methylbutanoate | HCID 67150345 | — |
| 生成物 | (S)-methyl 2-(5-(4-(3-(3-chlorophenyl)ureido)phenyl)oxazole-2-carboxamido)-3-methylbutanoate | HCID 52932716 | — |
反応手順
The title compound was synthesized analogous to Example 1, using 1-chloro-3-isocyanatobenzene (0.533 mmol) and intermediate 1. 1H NMR (DMSO-d6, 300 MHz): δ 9.056 (s, 1H), 9.013-8.986 (d, 2H), 7.820 (s, 1H), 7.799-7.770 (d, J=8.7 Hz, 2H), 7.728-7.704 (m, 1H), 7.631-7.601 (d, J=9 Hz, 2H), 7.347-7.268 (m, 2H), 7.059-7.024 (m, 1H), 4.328-4.277 (m, 1H), 3.680 (s, 3H), 2.286-2.218 (m, 1H), 0.980-0.958 (d, J=6.6 Hz, 6H); MS (ESI) m/z 469 (M−H), 470 (M+H)+.
情報源と証拠
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 特許番号 | US08722901B2 |
| 出典データセット | uspto-grants-2014_05 |
| ORD ID | ord-29dc0ff8e4b0406c9b4f2ab6b9201d8a |
| 出典メモ | uspto-grants-2014_05 |