Vitas-M small molecule compound
6-(furan-2-yl)-9-[4-(trifluoromethyl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK335927
SMILES O=C1CC(CC2=C1C(c1ccc(cc1)C(F)(F)F)n1c(N2)ncn1)c1ccco1
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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 C20H15F3N4O2 MW 400.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O2/c21-20(22,23)13-5-3-11(4-6-13)18-17-14(26-19-24-10-25-27(18)19)8-12(9-15(17)28)16-2-1-7-29-16/h1-7,10,12,18H,8-9H2,(H,24,25,26)InChIKey
PMAHBORQZVEAIB-UHFFFAOYSA-NSynonyms
6(furan2yl)9(4(trifluoromethyl)phenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
6(furan2yl)9(4(trifluoromethyl)phenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
C1C(CC(=O)C2=C1N=C3N=CNN3C2C4=CC=C(C=C4)C(F)(F)F)C5=CC=CO5
InChI=1SC20H15F3N4O2c2120(2223)135311(4613)181714(261924102527(18)19)812(915(17)28)162172916h17101218H89H2(H242526)
MFCD09964355
ZINC000018200411
ZINC000018200415
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