Vitas-M small molecule compound
(6Z)-6-{3-bromo-5-ethoxy-4-[(2-fluorobenzyl)oxy]benzylidene}-5-imino-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK082781
SMILES CCOc1cc(cc(c1OCc1ccccc1F)Br)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C
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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 C24H22BrFN4O3S MW 545.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrFN4O3S/c1-4-32-19-11-14(10-17(25)20(19)33-12-15-7-5-6-8-18(15)26)9-16-21(27)30-24(28-22(16)31)34-23(29-30)13(2)3/h5-11,13,27H,4,12H2,1-3H3/b16-9-,27-21-InChIKey
XVSVATGPVCAREI-HRYQGUFZSA-NSynonyms
(6Z)6(3bromo5ethoxy4((2fluorobenzyl)oxy)benzylidene)5imino2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(cc(c1OCc1ccccc1F)Br)C=C1C(=O)N=c2n(C1=N)nc(s2)C(C)C
MFCD02118796
STK082781
ZINC000100656717
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