Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]ethanone
Catalog ID
STK922460
SMILES CCCc1nc(SCC(=O)c2ccc3c(c2)OCO3)nc(c1)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 C16H16N2O4S MW 332.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4S/c1-2-3-11-7-15(20)18-16(17-11)23-8-12(19)10-4-5-13-14(6-10)22-9-21-13/h4-7H,2-3,8-9H2,1H3,(H,17,18,20)InChIKey
JHNJTJJNOLCBCY-UHFFFAOYSA-NSynonyms
848907-15-31(13benzodioxol5yl)2((4hydroxy6propylpyrimidin2yl)sulfanyl)ethanone
1(2HBENZO(34D)13DIOXOLEN5YL)2(4HYDROXY6PROPYLPYRIMIDIN2YLTHIO)ETHAN1ONE
1(BENZO(D)(13)DIOXOL5YL)2((4HYDROXY6PROPYLPYRIMIDIN2YL)THIO)ETHANONE
2(2(13BENZODIOXOL5YL)2OXOETHYL)SULFANYL6PROPYL1HPYRIMIDIN4ONE
848907153
CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC16H16N2O4Sc12311715(20)1816(1711)23812(19)10451314(610)2292113h47H2389H21H3(H171820)
MFCD08001280
ZINC000011027333
ZINC11027333
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