Vitas-M small molecule compound
(6E)-6-[(5-bromofuran-2-yl)methylidene]-5-imino-2-(1-phenylpropyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK062290
SMILES CCC(c1sc2=NC(=O)/C(=C/c3ccc(o3)Br)/C(=N)n2n1)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 C19H15BrN4O2S MW 443.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrN4O2S/c1-2-13(11-6-4-3-5-7-11)18-23-24-16(21)14(17(25)22-19(24)27-18)10-12-8-9-15(20)26-12/h3-10,13,21H,2H2,1H3/b14-10+,21-16-InChIKey
SHXFWSCQKGJCEF-CFRAVMCGSA-NSynonyms
(6E)6((5bromofuran2yl)methylidene)5imino2(1phenylpropyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCC(c1sc2=NC(=O)C(=Cc3ccc(o3)Br)C(=N)n2n1)c1ccccc1
MFCD03720706
STK062290
ZINC000009553635
ZINC000013897058
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