Vitas-M small molecule compound
(5E)-1-(2-fluorophenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK110997
SMILES O=C1NC(=S)N(C(=O)/C/1=C/c1cccn1C)c1ccccc1F
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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 C16H12FN3O2S MW 329.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12FN3O2S/c1-19-8-4-5-10(19)9-11-14(21)18-16(23)20(15(11)22)13-7-3-2-6-12(13)17/h2-9H,1H3,(H,18,21,23)/b11-9+InChIKey
MFMARZZDMBQGTG-PKNBQFBNSA-NSynonyms
(5E)1(2FLUOROPHENYL)5((1METHYL1HPYRROL2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(2FLUOROPHENYL)5((1METHYLPYRROL2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CN1C=CC=C1C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3F
InChI=1SC16H12FN3O2Sc11984510(19)91114(21)1816(23)20(15(11)22)13732612(13)17h29H1H3(H182123)b119+
MFCD03216692
O=C1NC(=S)N(C(=O)C1=Cc1cccn1C)c1ccccc1F
ZINC000000309673
ZINC00309673
ZINC309673
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