Vitas-M small molecule compound
6,6-dimethyl-9-[2-(trifluoromethyl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK326934
SMILES O=C1CC(C)(C)CC2=C1C(n1c(N2)ncn1)c1ccccc1C(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 C18H17F3N4O MW 362.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3N4O/c1-17(2)7-12-14(13(26)8-17)15(25-16(24-12)22-9-23-25)10-5-3-4-6-11(10)18(19,20)21/h3-6,9,15H,7-8H2,1-2H3,(H,22,23,24)InChIKey
NWIAKHUUFNBWDD-UHFFFAOYSA-NSynonyms
847465-02-566dimethyl9(2(trifluoromethyl)phenyl)1579tetrahydro(124)triazolo(51b)quinazolin8one
66dimethyl9(2(trifluoromethyl)phenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
847465025
CC1(CC2=C(C(N3C(=N2)N=CN3)C4=CC=CC=C4C(F)(F)F)C(=O)C1)C
InChI=1SC18H17F3N4Oc117(2)71214(13(26)817)15(2516(2412)2292325)10534611(10)18(1920)21h36915H78H212H3(H222324)
MFCD06752710
ZINC000004488715
ZINC000004488716
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