Vitas-M small molecule compound

2-(heptylsulfanyl)-5-(4-methylphenyl)-1,3,4-oxadiazole

Catalog ID
STL436592
SMILES CCCCCCCSc1nnc(o1)c1ccc(cc1)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 C16H22N2OS MW 290.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2OS/c1-3-4-5-6-7-12-20-16-18-17-15(19-16)14-10-8-13(2)9-11-14/h8-11H,3-7,12H2,1-2H3
InChIKey
PZTAHIGXBQRSFZ-UHFFFAOYSA-N
Synonyms

2(heptylsulfanyl)5(4methylphenyl)134oxadiazole
2heptylsulfanyl5(4methylphenyl)134oxadiazole
CCCCCCCSC1=NN=C(O1)C2=CC=C(C=C2)C
InChI=1SC16H22N2OSc134567122016181715(1916)1410813(2)91114h811H3712H212H3
MFCD09694663
ZINC000101376806
ZINC101376806

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Available files

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