Vitas-M small molecule compound

2-{[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]methyl}benzonitrile

Catalog ID
STK239965
SMILES CCc1nnc(o1)SCc1ccccc1C#N

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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 C12H11N3OS MW 245.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3OS/c1-2-11-14-15-12(16-11)17-8-10-6-4-3-5-9(10)7-13/h3-6H,2,8H2,1H3
InChIKey
XWSFFKPSXJJTCQ-UHFFFAOYSA-N
Synonyms

2(((5ethyl134oxadiazol2yl)sulfanyl)methyl)benzonitrile
2((5ETHYL134OXADIAZOL2YL)SULFANYLMETHYL)BENZONITRILE
CCC1=NN=C(O1)SCC2=CC=CC=C2C#N
InChI=1SC12H11N3OSc1211141512(1611)1781064359(10)713h36H28H21H3
MFCD08070475
ZINC000006697377
ZINC06697377
ZINC6697377

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Available files

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