Vitas-M small molecule compound

9-[4-(trifluoromethoxy)phenyl]-6-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one

Catalog ID
STK335924
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1n(C2c2ccc(cc2)OC(F)(F)F)ncn1

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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 C25H23F3N4O5 MW 516.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F3N4O5/c1-34-19-10-15(11-20(35-2)23(19)36-3)14-8-17-21(18(33)9-14)22(32-24(31-17)29-12-30-32)13-4-6-16(7-5-13)37-25(26,27)28/h4-7,10-12,14,22H,8-9H2,1-3H3,(H,29,30,31)
InChIKey
XOWIYVDMWRMGIG-UHFFFAOYSA-N
Synonyms

9(4(trifluoromethoxy)phenyl)6(345trimethoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(4(trifluoromethoxy)phenyl)6(345trimethoxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(N4C(=N3)N=CN4)C5=CC=C(C=C5)OC(F)(F)F)C(=O)C2
InChI=1SC25H23F3N4O5c134191015(1120(352)23(19)363)1481721(18(33)914)22(3224(3117)29123032)134616(7513)3725(2627)28h4710121422H89H213H3(H293031)
MFCD09964352
ZINC000018200394
ZINC000018200399

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Available files

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