Vitas-M small molecule compound
2,6-dihydroxy-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-3-[3-(trifluoromethyl)phenyl]pyrimidin-4(3H)-one
Catalog ID
STL530917
SMILES Oc1nc(O)n(c(=O)c1C1NCCc2c1[nH]c1c2cccc1)c1cccc(c1)C(F)(F)F
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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 C22H17F3N4O3 MW 442.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N4O3/c23-22(24,25)11-4-3-5-12(10-11)29-20(31)16(19(30)28-21(29)32)18-17-14(8-9-26-18)13-6-1-2-7-15(13)27-17/h1-7,10,18,26-27,30H,8-9H2,(H,28,32)InChIKey
IOMGYLGNCSOTCA-UHFFFAOYSA-NSynonyms
26dihydroxy5(2349tetrahydro1Hbetacarbolin1yl)3(3(trifluoromethyl)phenyl)pyrimidin4(3H)one
InChI=1SC22H17F3N4O3c2322(2425)1143512(1011)2920(31)16(19(30)2821(29)32)181714(892618)13612715(13)2717h171018262730H89H2(H2832)
MFCD07210471
ZINC000002134928
ZINC000009319026
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