Vitas-M small molecule compound

(7E)-7-({5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}methylidene)-3-(difluoromethyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Catalog ID
STK303263
SMILES FC(c1nnc2n1nc(C)/c(=C\c1ccc(o1)COc1cccc(c1Cl)Cl)/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 C18H12Cl2F2N4O2S MW 457.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12Cl2F2N4O2S/c1-9-14(29-18-24-23-17(16(21)22)26(18)25-9)7-10-5-6-11(28-10)8-27-13-4-2-3-12(19)15(13)20/h2-7,16H,8H2,1H3/b14-7+
InChIKey
SIMDWHMYQOCYGQ-VGOFMYFVSA-N
Synonyms
827592-73-4
(7E)7((5((23dichlorophenoxy)methyl)furan2yl)methylidene)3(difluoromethyl)6methyl(124)triazolo(34b)(134)thiadiazine
(7E)7((5((23dichlorophenoxy)methyl)furan2yl)methylidene)3(difluoromethyl)6methyl7H(124)triazolo(34b)(134)thiadiazine
827592734
CC1=NN2C(=NN=C2SC1=CC3=CC=C(O3)COC4=C(C(=CC=C4)Cl)Cl)C(F)F
FC(c1nnc2n1nc(C)c(=Cc1ccc(o1)COc1cccc(c1Cl)Cl)s2)F
InChI=1SC18H12Cl2F2N4O2Sc1914(2918242317(16(21)22)26(18)259)7105611(2810)8271342312(19)15(13)20h2716H8H21H3b147+
MFCD04051441
ZINC000002774965
ZINC2774965

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Available files

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