Vitas-M small molecule compound
1-(azepan-1-yl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone
Catalog ID
STK205445
SMILES O=C(N1CCCCCC1)CSc1nnc(o1)c1ccccc1
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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 C16H19N3O2S MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O2S/c20-14(19-10-6-1-2-7-11-19)12-22-16-18-17-15(21-16)13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2InChIKey
CWXUEYBEMNUZHH-UHFFFAOYSA-NSynonyms
1(AZEPAN1YL)2((5PHENYL134OXADIAZOL2YL)SULFANYL)ETHANONE
1AZAPERHYDROEPINYL2(5PHENYL(134OXADIAZOL2YLTHIO))ETHAN1ONE
1AZEPAN1YL2(5PHENYL(134)OXADIAZOL2YLSULFANYL)ETHANONE
C1CCCN(CC1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3
InChI=1SC16H19N3O2Sc2014(191061271119)122216181715(2116)138435913h3589H12671012H2
MFCD04274258
ZINC000002636760
ZINC02636760
ZINC2636760
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