Vitas-M small molecule compound

3-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-4-methyl-5-phenyl-4H-1,2,4-triazole

Catalog ID
STK230617
SMILES COc1ccccc1OCCSc1nnc(n1C)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 C18H19N3O2S MW 341.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S/c1-21-17(14-8-4-3-5-9-14)19-20-18(21)24-13-12-23-16-11-7-6-10-15(16)22-2/h3-11H,12-13H2,1-2H3
InChIKey
ZYOCLVOUDKPJOA-UHFFFAOYSA-N
Synonyms

3((2(2METHOXYPHENOXY)ETHYL)SULFANYL)4METHYL5PHENYL4H124TRIAZOLE
3(2(2METHOXYPHENOXY)ETHYLSULFANYL)4METHYL5PHENYL124TRIAZOLE
3(2(2METHOXYPHENOXY)ETHYLSULFANYL)4METHYL5PHENYL4H(124)TRIAZOLE
CN1C(=NN=C1SCCOC2=CC=CC=C2OC)C3=CC=CC=C3
InChI=1SC18H19N3O2Sc12117(148435914)192018(21)241312231611761015(16)222h311H1213H212H3
MFCD07790446
ZINC000004736060
ZINC04736060
ZINC4736060

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Available files

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