Vitas-M small molecule compound
4-{[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 1-benzofuran-2-carboxylate
Catalog ID
STK122422
SMILES O=C(c1cc2c(o1)cccc2)OCC#CCSc1nnc(o1)c1ccncc1
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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 C20H13N3O4S MW 391.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O4S/c24-19(17-13-15-5-1-2-6-16(15)26-17)25-11-3-4-12-28-20-23-22-18(27-20)14-7-9-21-10-8-14/h1-2,5-10,13H,11-12H2InChIKey
ZUCZAINLLDMSCJ-UHFFFAOYSA-NSynonyms
669716-16-94((5(PYRIDIN4YL)134OXADIAZOL2YL)SULFANYL)BUT2YN1YL1BENZOFURAN2CARBOXYLATE
4((5(pyridin4yl)134oxadiazol2yl)thio)but2yn1ylbenzofuran2carboxylate
4((5PYRIDIN4YL134OXADIAZOL2YL)SULFANYL)BUT2YNYL1BENZOFURAN2CARBOXYLATE
669716169
C1=CC=C2C(=C1)C=C(O2)C(=O)OCC#CCSC3=NN=C(O3)C4=CC=NC=C4
InChI=1SC20H13N3O4Sc2419(171315512616(15)2617)251134122820232218(2720)14792110814h1251013H1112H2
MFCD03722877
ZINC000002259696
ZINC02259696
ZINC2259696
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