Vitas-M small molecule compound
(6Z)-6-{3-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK015035
SMILES CCOc1cc(ccc1OCc1ccc(cc1)F)/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 C22H16F4N4O3S MW 492.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F4N4O3S/c1-2-32-17-10-13(5-8-16(17)33-11-12-3-6-14(23)7-4-12)9-15-18(27)30-21(28-19(15)31)34-20(29-30)22(24,25)26/h3-10,27H,2,11H2,1H3/b15-9-,27-18-InChIKey
JGPQYLCSKFCSSL-HDUFQABOSA-NSynonyms
(6Z)6(3ethoxy4((4fluorobenzyl)oxy)benzylidene)5imino2(trifluoromethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCc1ccc(cc1)F)C=C1C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
MFCD03136192
STK015035
ZINC000013940100
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