Vitas-M small molecule compound

3-(3,4-dichlorophenyl)-4-ethyl-5-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazole

Catalog ID
STK484102
SMILES CCn1c(SCc2ccc(cc2)F)nnc1c1ccc(c(c1)Cl)Cl

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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 C17H14Cl2FN3S MW 382.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2FN3S/c1-2-23-16(12-5-8-14(18)15(19)9-12)21-22-17(23)24-10-11-3-6-13(20)7-4-11/h3-9H,2,10H2,1H3
InChIKey
JFGXRXNSMLMFKE-UHFFFAOYSA-N
Synonyms

3(34dichlorophenyl)4ethyl5((4fluorobenzyl)sulfanyl)4H124triazole
3(34dichlorophenyl)4ethyl5((4fluorophenyl)methylsulfanyl)124triazole
5(34DICHLOROPHENYL)4ETHYL3((4FLUOROPHENYL)METHYLTHIO)124TRIAZOLE
CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC17H14Cl2FN3Sc122316(125814(18)15(19)912)212217(23)2410113613(20)7411h39H210H21H3
MFCD07033460
ZINC000013325505
ZINC13325505

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Available files

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