Vitas-M small molecule compound
(6E)-6-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK027060
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccc(o1)c1ccc(c(c1)Cl)C)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 C18H10ClF3N4O2S MW 438.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10ClF3N4O2S/c1-8-2-3-9(6-12(8)19)13-5-4-10(28-13)7-11-14(23)26-17(24-15(11)27)29-16(25-26)18(20,21)22/h2-7,23H,1H3/b11-7+,23-14+InChIKey
QRSFRNVFHXOEHP-XIPACHERSA-NSynonyms
(6E)6((5(3chloro4methylphenyl)furan2yl)methylidene)5imino2(trifluoromethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6((5(3chloro4methylphenyl)furan2yl)methylene)5imino2(trifluoromethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD02753128
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(o1)c1ccc(c(c1)Cl)C)C(F)(F)F
STK027060
ZINC000009136198
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Check stock on Vitas-MAvailable files
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