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-(2,5-dichlorophenyl)acetamide
Catalog ID
STK435035
SMILES CCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)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 C18H16Cl2F4N6OS MW 511.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2F4N6OS/c1-2-29-14(7-30-13(17(23)24)6-12(28-30)16(21)22)26-27-18(29)32-8-15(31)25-11-5-9(19)3-4-10(11)20/h3-6,16-17H,2,7-8H2,1H3,(H,25,31)InChIKey
YHWRKCHEMNDUHA-UHFFFAOYSA-NSynonyms
2((5((35bis(difluoromethyl)1Hpyrazol1yl)methyl)4ethyl4H124triazol3yl)sulfanyl)N(25dichlorophenyl)acetamide
2((5((35BIS(DIFLUOROMETHYL)PYRAZOL1YL)METHYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(25DICHLOROPHENYL)ACETAMIDE
2(5((35BIS(DIFLUOROMETHYL)PYRAZOLYL)METHYL)4ETHYL(124TRIAZOL3YLTHIO))N(25DICHLOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)Cl)CN3C(=CC(=N3)C(F)F)C(F)F
InChI=1SC18H16Cl2F4N6OSc122914(73013(17(23)24)612(2830)16(21)22)262718(29)32815(31)251159(19)3410(11)20h361617H278H21H3(H2531)
MFCD03943031
ZINC000020214401
ZINC20214401
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