Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(1-ethyl-1H-pyrazol-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethanone
Catalog ID
STL276352
SMILES CCn1ncc(c1)c1nnc(o1)SCC(=O)c1ccc2c(c1)OCCO2
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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 C17H16N4O4S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O4S/c1-2-21-9-12(8-18-21)16-19-20-17(25-16)26-10-13(22)11-3-4-14-15(7-11)24-6-5-23-14/h3-4,7-9H,2,5-6,10H2,1H3InChIKey
NUMGPBWHISFRSC-UHFFFAOYSA-NSynonyms
1(23dihydro14benzodioxin6yl)2((5(1ethyl1Hpyrazol4yl)134oxadiazol2yl)sulfanyl)ethanone
1(23dihydro14benzodioxin6yl)2((5(1ethylpyrazol4yl)134oxadiazol2yl)sulfanyl)ethanone
1(2H3HBENZO(34E)14DIOXAN6YL)2(5(1ETHYLPYRAZOL4YL)(134OXADIAZOL2YLTHIO))ETHAN1ONE
CCN1C=C(C=N1)C2=NN=C(O2)SCC(=O)C3=CC4=C(C=C3)OCCO4
InChI=1SC17H16N4O4Sc1221912(81821)16192017(2516)261013(22)11341415(711)24652314h3479H25610H21H3
MFCD10478684
ZINC000032604055
ZINC32604055
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