Vitas-M small molecule compound

3-(5-{(Z)-[5-imino-7-oxo-2-(trifluoromethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}furan-2-yl)benzoic acid

Catalog ID
STK012004
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1ccc(o1)c1cccc(c1)C(=O)O)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 C18H9F3N4O4S MW 434.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H9F3N4O4S/c19-18(20,21)16-24-25-13(22)11(14(26)23-17(25)30-16)7-10-4-5-12(29-10)8-2-1-3-9(6-8)15(27)28/h1-7,22H,(H,27,28)/b11-7-,22-13-
InChIKey
RHXOQJJKEHPGRU-HULUKOKISA-N
Synonyms

3(5((Z)(5imino7oxo2(trifluoromethyl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)furan2yl)benzoicacid
MFCD09959930
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(o1)c1cccc(c1)C(=O)O)C(F)(F)F
STK012004
ZINC000013939918

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Available files

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