Vitas-M small molecule compound
4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-N-(4-nitrophenyl)-1,3,5-triazin-2-amine
Catalog ID
STK031629
SMILES [O-][N+](=O)c1ccc(cc1)/C=N/Nc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(n1)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 C19H12F6N8O5 MW 546.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F6N8O5/c20-18(21,22)14(19(23,24)25)38-17-29-15(27-11-3-7-13(8-4-11)33(36)37)28-16(30-17)31-26-9-10-1-5-12(6-2-10)32(34)35/h1-9,14H,(H2,27,28,29,30,31)/b26-9+InChIKey
CCDPWGXQBOGIAY-JQAMDZJQSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)C=NNc1nc(Nc2ccc(cc2)(N+)(=O)(O))nc(n1)OC(C(F)(F)F)C(F)(F)F
4((111333hexafluoropropan2yl)oxy)6((2E)2(4nitrobenzylidene)hydrazinyl)N(4nitrophenyl)135triazin2amine
6(111333hexafluoropropan2yloxy)4N(4nitrophenyl)2N((E)(4nitrophenyl)methylideneamino)135triazine24diamine
C1=CC(=CC=C1C=NNC2=NC(=NC(=N2)NC3=CC=C(C=C3)(N+)(=O)(O))OC(C(F)(F)F)C(F)(F)F)(N+)(=O)(O)
InChI=1SC19H12F6N8O5c2018(2122)14(19(2324)25)38172915(27113713(8411)33(36)37)2816(3017)31269101512(6210)32(34)35h1914H(H22728293031)b269+
MFCD06652268
STK031629
ZINC000101415765
ZINC101415763
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