Vitas-M small molecule compound
(6Z)-6-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-5-imino-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK077252
SMILES COc1cc(cc(c1OCc1ccccc1F)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1
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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 C27H20ClFN4O4S MW 551.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClFN4O4S/c1-35-22-13-16(12-20(28)24(22)37-14-17-7-5-6-10-21(17)29)11-19-25(30)33-27(31-26(19)34)38-23(32-33)15-36-18-8-3-2-4-9-18/h2-13,30H,14-15H2,1H3/b19-11-,30-25-InChIKey
FBRHLNYMSLSOQD-PMXIJZHBSA-NSynonyms
(6Z)6(3chloro4((2fluorobenzyl)oxy)5methoxybenzylidene)5imino2(phenoxymethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
COc1cc(cc(c1OCc1ccccc1F)Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1
MFCD02951011
STK077252
ZINC000008494037
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