Vitas-M small molecule compound
4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STL396891
SMILES CCn1ncc(c1C)n1c(nnc1S)Cn1nc(cc1C)C(F)(F)F
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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 C14H16F3N7S MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16F3N7S/c1-4-22-9(3)10(6-18-22)24-12(19-20-13(24)25)7-23-8(2)5-11(21-23)14(15,16)17/h5-6H,4,7H2,1-3H3,(H,20,25)InChIKey
SROPZFPTXAGHMD-UHFFFAOYSA-NSynonyms
1005652-69-61005652696
4(1ETHYL5METHYL1HPYRAZOL4YL)5((5METHYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)METHYL)4H124TRIAZOLE3THIOL
4(1ETHYL5METHYLPYRAZOL4YL)3((5METHYL3(TRIFLUOROMETHYL)PYRAZOL1YL)METHYL)1H124TRIAZOLE5THIONE
4(1ETHYL5METHYLPYRAZOL4YL)5((5METHYL3(TRIFLUOROMETHYL)PYRAZOLYL)METHYL)124TRIAZOLE3THIOL
CCN1C(=C(C=N1)N2C(=NNC2=S)CN3C(=CC(=N3)C(F)(F)F)C)C
InChI=1SC14H16F3N7Sc14229(3)10(61822)2412(192013(24)25)7238(2)511(2123)14(1516)17h56H47H213H3(H2025)
MFCD04053080
ZINC000008339758
ZINC8339758
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