Vitas-M small molecule compound
(6E)-6-{4-[2-(2-chlorophenoxy)ethoxy]-3-methoxybenzylidene}-5-imino-2-phenyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK012771
SMILES COc1cc(ccc1OCCOc1ccccc1Cl)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1ccccc1
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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 C27H21ClN4O4S MW 533.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClN4O4S/c1-34-23-16-17(11-12-22(23)36-14-13-35-21-10-6-5-9-20(21)28)15-19-24(29)32-27(30-25(19)33)37-26(31-32)18-7-3-2-4-8-18/h2-12,15-16,29H,13-14H2,1H3/b19-15+,29-24+InChIKey
HVTWJVAQVIVIQG-LTBQFAOWSA-NSynonyms
(6E)6(4(2(2chlorophenoxy)ethoxy)3methoxybenzylidene)5imino2phenyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
COc1cc(ccc1OCCOc1ccccc1Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1
MFCD03184230
STK012771
ZINC000097957896
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