Vitas-M small molecule compound

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

Catalog ID
STK444576
SMILES Cc1nnc(n1c1cccc(c1)C(F)(F)F)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 C10H8F3N3S MW 259.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8F3N3S/c1-6-14-15-9(17)16(6)8-4-2-3-7(5-8)10(11,12)13/h2-5H,1H3,(H,15,17)
InChIKey
CZTKILOOJGUOBB-UHFFFAOYSA-N
Synonyms

3methyl4(3(trifluoromethyl)phenyl)1H124triazole5thione
5METHYL4(3(TRIFLUOROMETHYL)PHENYL)124TRIAZOLE3THIOL
5methyl4(3(trifluoromethyl)phenyl)4H124triazole3thiol
CC1=NNC(=S)N1C2=CC=CC(=C2)C(F)(F)F
InChI=1SC10H8F3N3Sc1614159(17)16(6)84237(58)10(1112)13h25H1H3(H1517)
MFCD04057180
ZINC000006402045
ZINC06402045
ZINC6402045

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Available files

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