Vitas-M small molecule compound

4-(4-{4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-1,3,5-triazin-2-yl}piperazin-1-yl)-N-ethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine

Catalog ID
STK082356
SMILES CCNc1nc(OCC(F)(F)F)nc(n1)N1CCN(CC1)c1nc(nc(n1)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(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 C20H18F15N9O3 MW 717.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F15N9O3/c1-2-36-10-37-11(39-13(38-10)45-7-16(21,22)23)43-3-5-44(6-4-43)12-40-14(46-8(17(24,25)26)18(27,28)29)42-15(41-12)47-9(19(30,31)32)20(33,34)35/h8-9H,2-7H2,1H3,(H,36,37,38,39)
InChIKey
LNMTVXYIFVLKKE-UHFFFAOYSA-N
Synonyms

4(4(46bis((111333hexafluoropropan2yl)oxy)135triazin2yl)piperazin1yl)Nethyl6(222trifluoroethoxy)135triazin2amine
4(4(46bis(111333hexafluoropropan2yloxy)135triazin2yl)piperazin1yl)Nethyl6(222trifluoroethoxy)135triazin2amine
CCNC1=NC(=NC(=N1)N2CCN(CC2)C3=NC(=NC(=N3)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)OCC(F)(F)F
CCNc1nc(OCC(F)(F)F)nc(n1)N1CCN(CC1)c1nc(nc(n1)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F
InChI=1SC20H18F15N9O3c1236103711(3913(3810)45716(2122)23)433544(6443)124014(468(17(2425)26)18(2728)29)4215(4112)479(19(3031)32)20(3334)35h89H27H21H3(H36373839)
MFCD03730975
STK082356
ZINC000097940227
ZINC97940227

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Available files

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