Vitas-M small molecule compound

2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-6-[(pyrimidin-2-ylsulfanyl)methyl]pyrimidin-4-ol

Catalog ID
STK618456
SMILES Oc1cc(CSc2ncccn2)nc(n1)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H22N6O3S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3S/c28-19-11-16(13-31-21-22-4-1-5-23-21)24-20(25-19)27-8-6-26(7-9-27)12-15-2-3-17-18(10-15)30-14-29-17/h1-5,10-11H,6-9,12-14H2,(H,24,25,28)
InChIKey
MXIJQUGPZSSKSM-UHFFFAOYSA-N
Synonyms
925018-20-8
2(4(13benzodioxol5ylmethyl)piperazin1yl)6((pyrimidin2ylsulfanyl)methyl)pyrimidin4ol
2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)6(PYRIMIDIN2YLTHIOMETHYL)3HYDROPYRIMIDIN4ONE
MFCD09789711
ZINC000009421050
ZINC9421050

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Available files

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