Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-6-hydroxy-5-(prop-2-en-1-yl)pyrimidin-4(3H)-one
Catalog ID
STK299015
SMILES C=CCc1c(O)nc([nH]c1=O)SCc1ccccc1Cl
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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 C14H13ClN2O2S MW 308.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClN2O2S/c1-2-5-10-12(18)16-14(17-13(10)19)20-8-9-6-3-4-7-11(9)15/h2-4,6-7H,1,5,8H2,(H2,16,17,18,19)InChIKey
CCKICVVSVKQWSE-UHFFFAOYSA-NSynonyms
2((2chlorobenzyl)sulfanyl)6hydroxy5(prop2en1yl)pyrimidin4(3H)one
2((2CHLOROPHENYL)METHYLSULFANYL)4HYDROXY5PROP2ENYL1HPYRIMIDIN6ONE
C=CCC1=C(N=C(NC1=O)SCC2=CC=CC=C2Cl)O
C=CCc1c(O)nc((nH)c1=O)SCc1ccccc1Cl
InChI=1SC14H13ClN2O2Sc1251012(18)1614(1713(10)19)2089634711(9)15h2467H158H2(H216171819)
MFCD03697407
ZINC000000091179
ZINC00091179
ZINC91179
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