HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1965092Generated: October 26, 2026
2-Oxopropanethioamide → 6'-Bromo-4-methoxy-5''-methyl-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazole]-4''(3''H)-thione
https://huagongshe.com/reaction/1965092
Participants
| Role | Name | HCID | Charge |
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| Reactant | 2-Oxopropanethioamide | HCID 20765237 | — |
| Reactant | Trans-6'-bromo-4-methoxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-imine | HCID 67979447 | — |
| Solvent | Methanol | HCID 887 | — |
| Product | 6'-Bromo-4-methoxy-5''-methyl-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazole]-4''(3''H)-thione | HCID 86667271 | 64.5% |
Reaction Steps
6′-Bromo-4-methoxyspiro[cyclohexane-1,2′-inden]-1′(3′H)-imine (Example 19 Step 2, 1.41 g, 4.57 mmol) and 2-oxopropanethioamide (Intermediate 2, 1.42 g, 13.7 mmol) were dissolved in dry MeOH (30 mL) and the resulting solution was heated at 60° C. under an atmosphere of nitrogen. After 15 h the reaction was allowed to cool to r.t. A precipitate had formed which was filtered off and dried in vacuo, yielding the title compound (1.16 g, 64% yield) as a mixture of isomers. 1H NMR (500 MHz, DMSO-d6) δ ppm 1.18 (m, 4 H), 1.47 (m, 2 H), 1.87 (m, 2 H), 2.27 (m, 3 H), 3.03 (m, 3 H), 3.20 (s, 3 H), 6.98 (d, 1 H), 7.34 (d, 1 H), 7.51 (dd, 1 H); MS (APCI+) m/z 394 [M+H]+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08415483B2 |
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| Source dataset | uspto-grants-2013_04 |
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| ORD ID | ord-2c93ef03a9f7467d959dbdf993ba87b2 |
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| Source note | uspto-grants-2013_04 |
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