Vitas-M small molecule compound

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

Catalog ID
STK442452
SMILES Fc1ccc(cc1)OCc1nnc(n1C)S

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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 C10H10FN3OS MW 239.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10FN3OS/c1-14-9(12-13-10(14)16)6-15-8-4-2-7(11)3-5-8/h2-5H,6H2,1H3,(H,13,16)
InChIKey
YEZUXWFDPJDYQM-UHFFFAOYSA-N
Synonyms
667437-43-6
3((4FLUOROPHENOXY)METHYL)4METHYL1H124TRIAZOLE5THIONE
5((4FLUOROPHENOXY)METHYL)4METHYL124TRIAZOLE3THIOL
5((4fluorophenoxy)methyl)4methyl4H124triazole3thiol
5(4FLUOROPHENOXYMETHYL)4METHYL124TRIAZOLE3THIOL
667437436
CN1C(=NNC1=S)COC2=CC=C(C=C2)F
InChI=1SC10H10FN3OSc1149(121310(14)16)6158427(11)358h25H6H21H3(H1316)
MFCD03900680
ZINC000002518747
ZINC2518747

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Available files

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