Vitas-M small molecule compound
2-({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Catalog ID
STK964462
SMILES CCn1c(SCC(=O)N2N=C(CC2(O)C(F)(F)F)C)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 C20H21ClF3N5O2S MW 487.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClF3N5O2S/c1-3-28-17(15-8-14(15)12-4-6-13(21)7-5-12)25-26-18(28)32-10-16(30)29-19(31,20(22,23)24)9-11(2)27-29/h4-7,14-15,31H,3,8-10H2,1-2H3InChIKey
BJMOYXGMSRESBW-UHFFFAOYSA-NSynonyms
1024310-88-01024310880
2((5(2(4CHLOROPHENYL)CYCLOPROPYL)4ETHYL124TRIAZOL3YL)SULFANYL)1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)ETHANONE
2((5(2(4chlorophenyl)cyclopropyl)4ethyl4H124triazol3yl)sulfanyl)1(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)ethanone
CCN1C(=NN=C1SCC(=O)N2C(CC(=N2)C)(C(F)(F)F)O)C3CC3C4=CC=C(C=C4)Cl
InChI=1SC20H21ClF3N5O2Sc132817(15814(15)124613(21)7512)252618(28)321016(30)2919(3120(2223)24)911(2)2729h47141531H3810H212H3
MFCD04049555
ZINC000020602332
ZINC000252430634
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