Vitas-M small molecule compound

4-ethyl-5-[(4-fluorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK442008
SMILES CCn1c(COc2ccc(cc2)F)nnc1S

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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 C11H12FN3OS MW 253.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12FN3OS/c1-2-15-10(13-14-11(15)17)7-16-9-5-3-8(12)4-6-9/h3-6H,2,7H2,1H3,(H,14,17)
InChIKey
HRROXJRZFCPWHY-UHFFFAOYSA-N
Synonyms
667436-83-1
4ETHYL3((4FLUOROPHENOXY)METHYL)1H124TRIAZOLE5THIONE
4ETHYL5((4FLUOROPHENOXY)METHYL)124TRIAZOLE3THIOL
4ethyl5((4fluorophenoxy)methyl)4H124triazole3thiol
4ETHYL5(4FLUOROPHENOXYMETHYL)124TRIAZOLE3THIOL
667436831
CCN1C(=NNC1=S)COC2=CC=C(C=C2)F
InChI=1SC11H12FN3OSc121510(131411(15)17)7169538(12)469h36H27H21H3(H1417)
MFCD03900609
ZINC000002518743
ZINC02518743
ZINC2518743

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Available files

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