Vitas-M small molecule compound

1-(azepan-1-yl)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone

Catalog ID
STK261002
SMILES O=C(N1CCCCCC1)CSc1nnc(o1)C

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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 C11H17N3O2S MW 255.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H17N3O2S/c1-9-12-13-11(16-9)17-8-10(15)14-6-4-2-3-5-7-14/h2-8H2,1H3
InChIKey
UFFMQULCQNTDMY-UHFFFAOYSA-N
Synonyms

1(azepan1yl)2((5methyl134oxadiazol2yl)sulfanyl)ethanone
2(1AZEPANYL)2OXOETHYL5METHYL134OXADIAZOL2YLSULFIDE
CC1=NN=C(O1)SCC(=O)N2CCCCCC2
InChI=1SC11H17N3O2Sc19121311(169)17810(15)1464235714h28H21H3
MFCD06099528
ZINC000008715391
ZINC08715391
ZINC8715391

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.