Vitas-M small molecule compound
(7E)-3-(difluoromethyl)-7-({5-[(4-nitrophenoxy)methyl]furan-2-yl}methylidene)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STL177150
SMILES FC(c1nnc2n1nc(c1ccccc1)/c(=C\c1ccc(o1)COc1ccc(cc1)[N+](=O)[O-])/s2)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 C23H15F2N5O4S MW 495.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15F2N5O4S/c24-21(25)22-26-27-23-29(22)28-20(14-4-2-1-3-5-14)19(35-23)12-17-10-11-18(34-17)13-33-16-8-6-15(7-9-16)30(31)32/h1-12,21H,13H2/b19-12+InChIKey
OZRCFJDTUWLAQA-XDHOZWIPSA-NSynonyms
827593-46-4(7E)3(difluoromethyl)7((5((4nitrophenoxy)methyl)furan2yl)methylidene)6phenyl(124)triazolo(34b)(134)thiadiazine
(7E)3(difluoromethyl)7((5((4nitrophenoxy)methyl)furan2yl)methylidene)6phenyl7H(124)triazolo(34b)(134)thiadiazine
827593464
C1=CC=C(C=C1)C2=NN3C(=NN=C3SC2=CC4=CC=C(O4)COC5=CC=C(C=C5)(N+)(=O)(O))C(F)F
FC(c1nnc2n1nc(c1ccccc1)c(=Cc1ccc(o1)COc1ccc(cc1)(N+)(=O)(O))s2)F
InChI=1SC23H15F2N5O4Sc2421(25)2226272329(22)2820(144213514)19(3523)1217101118(3417)1333168615(7916)30(31)32h11221H13H2b1912+
MFCD04051567
ZINC000002777707
ZINC2777707
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