Vitas-M small molecule compound

N'-[5-({4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-1,3,5-triazin-2-yl}amino)pentyl]-N,N-diphenyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine

Catalog ID
STK021750
SMILES FC(COc1nc(NCCCCCNc2nc(nc(n2)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)nc(n1)N(c1ccccc1)c1ccccc1)(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 C31H26F15N9O3 MW 857.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26F15N9O3/c32-27(33,34)16-56-24-50-21(49-23(53-24)55(17-10-4-1-5-11-17)18-12-6-2-7-13-18)47-14-8-3-9-15-48-22-51-25(57-19(28(35,36)37)29(38,39)40)54-26(52-22)58-20(30(41,42)43)31(44,45)46/h1-2,4-7,10-13,19-20H,3,8-9,14-16H2,(H,47,49,50,53)(H,
InChIKey
CGTYBVAECOBYTF-UHFFFAOYSA-N
Synonyms

4N(5((46bis(111333hexafluoropropan2yloxy)135triazin2yl)amino)pentyl)2N2Ndiphenyl6(222trifluoroethoxy)135triazine24diamine
C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=NC(=NC(=N3)NCCCCCNC4=NC(=NC(=N4)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)OCC(F)(F)F
FC(COc1nc(NCCCCCNc2nc(nc(n2)OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)nc(n1)N(c1ccccc1)c1ccccc1)(F)F
InChI=1SC31H26F15N9O3c3227(3334)1656245021(4923(5324)55(17104151117)18126271318)47148391548225125(5719(28(3536)37)29(3839)40)5426(5222)5820(30(4142)43)31(4445)46h124710131920H3891416H2(H47495053)(H48515254)
MFCD00756662
N(5((46bis((111333hexafluoropropan2yl)oxy)135triazin2yl)amino)pentyl)NNdiphenyl6(222trifluoroethoxy)135triazine24diamine
STK021750
ZINC000150434335
ZINC150434335

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Available files

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