Vitas-M small molecule compound

3-{5-[(2-chlorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}pyridine

Catalog ID
STK478615
SMILES CCn1c(SCc2ccccc2Cl)nnc1c1cccnc1

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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 C16H15ClN4S MW 330.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4S/c1-2-21-15(12-7-5-9-18-10-12)19-20-16(21)22-11-13-6-3-4-8-14(13)17/h3-10H,2,11H2,1H3
InChIKey
YCRQXBFFTSUFSD-UHFFFAOYSA-N
Synonyms

3((2CHLOROPHENYL)METHYLTHIO)4ETHYL5(3PYRIDYL)124TRIAZOLE
3(5((2chlorobenzyl)sulfanyl)4ethyl4H124triazol3yl)pyridine
3(5((2CHLOROPHENYL)METHYLSULFANYL)4ETHYL124TRIAZOL3YL)PYRIDINE
CCN1C(=NN=C1SCC2=CC=CC=C2Cl)C3=CN=CC=C3
InChI=1SC16H15ClN4Sc122115(12759181012)192016(21)221113634814(13)17h310H211H21H3
MFCD02589103
ZINC000000422171
ZINC00422171
ZINC422171

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Available files

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