Vitas-M small molecule compound
1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STK305046
SMILES CCn1c(SCC(=O)N2N=C(CC2(O)C(F)F)C(F)F)nnc1C1CC1c1ccc(cc1)Cl
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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 C20H20ClF4N5O2S MW 505.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClF4N5O2S/c1-2-29-17(13-7-12(13)10-3-5-11(21)6-4-10)26-27-19(29)33-9-15(31)30-20(32,18(24)25)8-14(28-30)16(22)23/h3-6,12-13,16,18,32H,2,7-9H2,1H3InChIKey
RCRCPDQIIUIMBL-UHFFFAOYSA-NSynonyms
1024310-84-61(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)2((5(2(4chlorophenyl)cyclopropyl)4ethyl4H124triazol3yl)sulfanyl)ethanone
1(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)2((5(2(4CHLOROPHENYL)CYCLOPROPYL)4ETHYL124TRIAZOL3YL)SULFANYL)ETHANONE
1024310846
CCN1C(=NN=C1SCC(=O)N2C(CC(=N2)C(F)F)(C(F)F)O)C3CC3C4=CC=C(C=C4)Cl
InChI=1SC20H20ClF4N5O2Sc122917(13712(13)103511(21)6410)262719(29)33915(31)3020(3218(24)25)814(2830)16(22)23h361213161832H279H21H3
MFCD04049319
ZINC000013959425
ZINC000245327786
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