Vitas-M small molecule compound
(6E)-6-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK032434
SMILES CCc1nn2c(=NC(=O)/C(=C/c3c(C)nn(c3Cl)c3ccccc3)/C2=N)s1
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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 C18H15ClN6OS MW 398.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN6OS/c1-3-14-23-25-16(20)13(17(26)21-18(25)27-14)9-12-10(2)22-24(15(12)19)11-7-5-4-6-8-11/h4-9,20H,3H2,1-2H3/b13-9+,20-16-InChIKey
IWCYENBWEJPXTF-QQUAUJCSSA-NSynonyms
(6E)6((5chloro3methyl1phenyl1Hpyrazol4yl)methylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCc1nn2c(=NC(=O)C(=Cc3c(C)nn(c3Cl)c3ccccc3)C2=N)s1
MFCD08050347
STK032434
ZINC000023343478
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