Vitas-M small molecule compound

3-[(2-chloro-6-fluorobenzyl)sulfanyl]-5-cyclohexyl-4-ethyl-4H-1,2,4-triazole

Catalog ID
STK408301
SMILES CCn1c(SCc2c(F)cccc2Cl)nnc1C1CCCCC1

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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 C17H21ClFN3S MW 353.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21ClFN3S/c1-2-22-16(12-7-4-3-5-8-12)20-21-17(22)23-11-13-14(18)9-6-10-15(13)19/h6,9-10,12H,2-5,7-8,11H2,1H3
InChIKey
QSVFIANNEWOTGK-UHFFFAOYSA-N
Synonyms

3((2chloro6fluorobenzyl)sulfanyl)5cyclohexyl4ethyl4H124triazole
3((2chloro6fluorophenyl)methylsulfanyl)5cyclohexyl4ethyl124triazole
5((6CHLORO2FLUOROPHENYL)METHYLTHIO)3CYCLOHEXYL4ETHYL124TRIAZOLE
CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3CCCCC3
InChI=1SC17H21ClFN3Sc122216(127435812)202117(22)23111314(18)961015(13)19h691012H257811H21H3
MFCD04384900
ZINC000006356670
ZINC06356670
ZINC6356670

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Available files

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