Vitas-M small molecule compound
5-[(benzylsulfanyl)methyl]-4-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK440474
SMILES Sc1nnc(n1c1ccccc1C(F)(F)F)CSCc1ccccc1
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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 C17H14F3N3S2 MW 381.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14F3N3S2/c18-17(19,20)13-8-4-5-9-14(13)23-15(21-22-16(23)24)11-25-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,22,24)InChIKey
PEHOAZBVXYUWKI-UHFFFAOYSA-NSynonyms
3(BENZYLSULFANYLMETHYL)4(2(TRIFLUOROMETHYL)PHENYL)1H124TRIAZOLE5THIONE
5((benzylsulfanyl)methyl)4(2(trifluoromethyl)phenyl)4H124triazole3thiol
5((PHENYLMETHYLTHIO)METHYL)4(2(TRIFLUOROMETHYL)PHENYL)124TRIAZOLE3THIOL
C1=CC=C(C=C1)CSCC2=NNC(=S)N2C3=CC=CC=C3C(F)(F)F
InChI=1SC17H14F3N3S2c1817(1920)13845914(13)2315(212216(23)24)112510126213712h19H1011H2(H2224)
MFCD03946269
ZINC000017077953
ZINC17077953
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