Vitas-M small molecule compound
(6Z)-5-imino-6-[(1-{2-[2-(propan-2-yl)phenoxy]ethyl}-1H-pyrrol-2-yl)methylidene]-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK035292
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cccn1CCOc1ccccc1C(C)C)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 C22H20F3N5O2S MW 475.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3N5O2S/c1-13(2)15-7-3-4-8-17(15)32-11-10-29-9-5-6-14(29)12-16-18(26)30-21(27-19(16)31)33-20(28-30)22(23,24)25/h3-9,12-13,26H,10-11H2,1-2H3/b16-12-,26-18-InChIKey
RZTZBGGHDFXKPK-AQRRZUFUSA-NSynonyms
(6Z)5imino6((1(2(2(propan2yl)phenoxy)ethyl)1Hpyrrol2yl)methylidene)2(trifluoromethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
MFCD08050442
O=C1N=c2sc(nn2C(=N)C1=Cc1cccn1CCOc1ccccc1C(C)C)C(F)(F)F
STK035292
ZINC000009246256
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