Vitas-M small molecule compound
2-[(5-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylpropyl)acetamide
Catalog ID
STL399161
SMILES CCn1c(SCC(=O)NCC(C)C)nnc1Cn1nc(cc1C(F)F)C(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 C16H22F4N6OS MW 422.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22F4N6OS/c1-4-25-12(7-26-11(15(19)20)5-10(24-26)14(17)18)22-23-16(25)28-8-13(27)21-6-9(2)3/h5,9,14-15H,4,6-8H2,1-3H3,(H,21,27)InChIKey
BVJJADCIZWCBAI-UHFFFAOYSA-NSynonyms
1005611-43-71005611437
2((5((35BIS(DIFLUOROMETHYL)1HPYRAZOL1YL)METHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(2METHYLPROPYL)ACETAMIDE
2((5((35BIS(DIFLUOROMETHYL)PYRAZOL1YL)METHYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(2METHYLPROPYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NCC(C)C)CN2C(=CC(=N2)C(F)F)C(F)F
InChI=1SC16H22F4N6OSc142512(72611(15(19)20)510(2426)14(17)18)222316(25)28813(27)2169(2)3h591415H468H213H3(H2127)
MFCD04130435
ZINC000002792570
ZINC02792570
ZINC2792570
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