HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1773905Generated: November 3, 2026
Isopropyl Isothiocyanate → HCID 86703984, compound
https://huagongshe.com/reaction/1773905
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Isopropyl Isothiocyanate | HCID 75263 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | HCID 86703979 | HCID 86703979 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | HCID 86703984 | HCID 86703984 | — |
Reaction Steps
To a solution of 4-[1-methyl-4-(1-methyl piperidin-4-yloxy)-9,10-dihydro-4H-3,10a-diaza-benzo[f]azulen-2-yl]-phenylamine (example 173) (50 mg, 0.124 mmole) in ACN (1 mL) are added DIEA (65 μL, 0.372 mmole) and isopropylisothiocyanate (18.8 mg, 0.182 mmole). The reaction mixture is heated overnight at 80° C. Solvent is removed under reduced pressure. The residue is purified by silica gel chromatography eluting with (CH2Cl2:MeOH:NH4OH) from (98:2:02) to (96.5:3.5:0.35) to give 1-isopropyl-3-{4-[1-methyl-4-(1-methylpiperidin-4-yloxy)-9,10-dihydro-4H-3,10a-diazabenzo[f]azulen-2-yl]-phenyl}-thiourea. [M+H]+=504.37.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09255101B2 |
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| Source dataset | uspto-grants-2016_02 |
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| ORD ID | ord-59d65d7eda524fa6adc3fb2e54513f80 |
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| Source note | uspto-grants-2016_02 |
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