Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Catalog ID
STK620760
SMILES SC1=NC(=O)/C(=C/c2cc(n(c2C)c2cccnc2)C)/C(=N1)O
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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 C16H14N4O2S MW 326.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O2S/c1-9-6-11(7-13-14(21)18-16(23)19-15(13)22)10(2)20(9)12-4-3-5-17-8-12/h3-8H,1-2H3,(H2,18,19,21,22,23)InChIKey
OAPGFKJDKJUOBP-UHFFFAOYSA-NSynonyms
(5E)5((25dimethyl1(pyridin3yl)1Hpyrrol3yl)methylidene)6hydroxy2sulfanylpyrimidin4(5H)one
5((25DIMETHYL1(3PYRIDYL)PYRROL3YL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((25DIMETHYL1PYRIDIN3YL1HPYRROL3YL)METHYLENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((25DIMETHYL1PYRIDIN3YLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=O)NC(=S)NC3=O
InChI=1SC16H14N4O2Sc19611(71314(21)1816(23)1915(13)22)10(2)20(9)1243517812h38H12H3(H21819212223)
MFCD09795154
SC1=NC(=O)C(=Cc2cc(n(c2C)c2cccnc2)C)C(=N1)O
ZINC379643
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