Vitas-M small molecule compound
(6Z)-2-butyl-6-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK059271
SMILES CCCCc1sc2=NC(=O)/C(=C\c3cc(Cl)c(c(c3)OC)OCc3ccccc3F)/C(=N)n2n1
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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 C24H22ClFN4O3S MW 500.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClFN4O3S/c1-3-4-9-20-29-30-22(27)16(23(31)28-24(30)34-20)10-14-11-17(25)21(19(12-14)32-2)33-13-15-7-5-6-8-18(15)26/h5-8,10-12,27H,3-4,9,13H2,1-2H3/b16-10-,27-22-InChIKey
JCYCGDSQABNWEG-QNUVUSRKSA-NSynonyms
(6Z)2butyl6(3chloro4((2fluorobenzyl)oxy)5methoxybenzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCc1sc2=NC(=O)C(=Cc3cc(Cl)c(c(c3)OC)OCc3ccccc3F)C(=N)n2n1
MFCD08051462
STK059271
ZINC000009553397
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