Vitas-M small molecule compound
[3-(3-chloro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl][5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STL171500
SMILES CC1=NN(C(C1)(O)C(F)(F)F)C(=O)C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)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 C18H21ClF3N5O2 MW 431.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClF3N5O2/c1-10-3-17(29,18(20,21)22)27(24-10)13(28)15-4-11-2-12(5-15)7-16(6-11,8-15)26-9-23-14(19)25-26/h9,11-12,29H,2-8H2,1H3InChIKey
SUUHRRZMSHTKNR-UHFFFAOYSA-NSynonyms
675840-96-7(3(3CHLORO124TRIAZOL1YL)1ADAMANTYL)(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)METHANONE
(3(3chloro1H124triazol1yl)tricyclo(3311~37~)dec1yl)(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
675840967
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC(=N5)Cl
InChI=1SC18H21ClF3N5O2c110317(2918(2021)22)27(2410)13(28)15411212(515)716(611815)2692314(19)2526h9111229H28H21H3
ZINC000035657526
ZINC000035657527
Check stock
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