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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1773905Generated: November 3, 2026

Isopropyl Isothiocyanate → HCID 86703984, compound

https://huagongshe.com/reaction/1773905

Reaction equation

Participants

RoleNameHCIDCharge
ReactantIsopropyl IsothiocyanateHCID 75263—
ReactantDiisopropylethylamineHCID 81531—
ReactantHCID 86703979HCID 86703979—
SolventAcetonitrileHCID 6342—
ProductHCID 86703984HCID 86703984—

Reaction Conditions

Temperature80 °C

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

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09255101B2
Source datasetuspto-grants-2016_02
ORD IDord-59d65d7eda524fa6adc3fb2e54513f80
Source noteuspto-grants-2016_02