Vitas-M small molecule compound
(5E)-5-[2-(difluoromethoxy)benzylidene]-9-[2-(difluoromethoxy)phenyl]-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazoline
Catalog ID
STK889102
SMILES FC(Oc1ccccc1/C=C/1\CCCC2=C1Nc1ncnn1C2c1ccccc1OC(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 C24H20F4N4O2 MW 472.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20F4N4O2/c25-22(26)33-18-10-3-1-6-14(18)12-15-7-5-9-17-20(15)31-24-29-13-30-32(24)21(17)16-8-2-4-11-19(16)34-23(27)28/h1-4,6,8,10-13,21-23H,5,7,9H2,(H,29,30,31)/b15-12+InChIKey
MRZVVBDVUPJFGQ-NTCAYCPXSA-NSynonyms
(5E)5(2(difluoromethoxy)benzylidene)9(2(difluoromethoxy)phenyl)456789hexahydro(124)triazolo(51b)quinazoline
(5E)9(2(difluoromethoxy)phenyl)5((2(difluoromethoxy)phenyl)methylidene)6789tetrahydro1H(124)triazolo(51b)quinazoline
C1CC(=CC2=CC=CC=C2OC(F)F)C3=C(C1)C(N4C(=N3)N=CN4)C5=CC=CC=C5OC(F)F
FC(Oc1ccccc1C=C1CCCC2=C1Nc1ncnn1C2c1ccccc1OC(F)F)F
InChI=1SC24H20F4N4O2c2522(26)33181031614(18)12157591720(15)312429133032(24)21(17)168241119(16)3423(27)28h146810132123H579H2(H293031)b1512+
MFCD06327606
ZINC000012561593
ZINC000012561594
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