Vitas-M small molecule compound

N-{4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-1,3,5-triazin-2-yl}-N'-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]butane-1,4-diamine

Catalog ID
STK045001
SMILES Fc1c(F)c(NCCCCNc2nc(nc(n2)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)c(c(c1C(F)(F)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 C20H12F19N5O2 MW 715.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12F19N5O2/c21-6-5(16(25,26)27)7(22)9(24)10(8(6)23)40-3-1-2-4-41-13-42-14(45-11(17(28,29)30)18(31,32)33)44-15(43-13)46-12(19(34,35)36)20(37,38)39/h11-12,40H,1-4H2,(H,41,42,43,44)
InChIKey
VEJSBHKFUZQWBN-UHFFFAOYSA-N
Synonyms

C(CCNC1=NC(=NC(=N1)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)CNC2=C(C(=C(C(=C2F)F)C(F)(F)F)F)F
Fc1c(F)c(NCCCCNc2nc(nc(n2)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)c(c(c1C(F)(F)F)F)F
InChI=1SC20H12F19N5O2c2165(16(2526)27)7(22)9(24)10(8(6)23)40312441134214(4511(17(2829)30)18(3132)33)4415(4313)4612(19(3435)36)20(3738)39h111240H14H2(H41424344)
MFCD00633033
N(46bis((111333hexafluoropropan2yl)oxy)135triazin2yl)N(2356tetrafluoro4(trifluoromethyl)phenyl)butane14diamine
N(46bis(111333hexafluoropropan2yloxy)135triazin2yl)N(2356tetrafluoro4(trifluoromethyl)phenyl)butane14diamine
STK045001
ZINC000095100422
ZINC95100422

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.