Vitas-M small molecule compound
(6Z)-6-{4-[2-(3,5-dimethylphenoxy)ethoxy]-3-ethoxybenzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK038118
SMILES CCOc1cc(ccc1OCCOc1cc(C)cc(c1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C25H23F3N4O4S MW 532.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F3N4O4S/c1-4-34-20-13-16(5-6-19(20)36-8-7-35-17-10-14(2)9-15(3)11-17)12-18-21(29)32-24(30-22(18)33)37-23(31-32)25(26,27)28/h5-6,9-13,29H,4,7-8H2,1-3H3/b18-12-,29-21-InChIKey
SFPQJHCMLGGFOE-DDZAIWHLSA-NSynonyms
(6Z)6(4(2(35dimethylphenoxy)ethoxy)3ethoxybenzylidene)5imino2(trifluoromethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCOc1cc(C)cc(c1)C)C=C1C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
MFCD08050558
STK038118
ZINC000100711555
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