Vitas-M small molecule compound

3-[(4-ethoxybenzyl)sulfanyl]-5-propyl-4H-1,2,4-triazole

Catalog ID
STK830993
SMILES CCCc1nnc([nH]1)SCc1ccc(cc1)OCC

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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 C14H19N3OS MW 277.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N3OS/c1-3-5-13-15-14(17-16-13)19-10-11-6-8-12(9-7-11)18-4-2/h6-9H,3-5,10H2,1-2H3,(H,15,16,17)
InChIKey
XQOIUSZTYROMSQ-UHFFFAOYSA-N
Synonyms
375831-03-1
3((4ethoxybenzyl)sulfanyl)5propyl4H124triazole
3((4ethoxybenzyl)thio)5propyl4H124triazole
3((4ETHOXYPHENYL)METHYLSULFANYL)5PROPYL1H124TRIAZOLE
375831031
CCCC1=NC(=NN1)SCC2=CC=C(C=C2)OCC
CCCc1nnc((nH)1)SCc1ccc(cc1)OCC
InChI=1SC14H19N3OSc135131514(171613)1910116812(9711)1842h69H3510H212H3(H151617)
MFCD02239987
ZINC000006493339
ZINC06493339
ZINC6493339

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Available files

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