Vitas-M small molecule compound
N-(4-chloro-2,5-dimethoxyphenyl)-4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carbothioamide
Catalog ID
STK207008
SMILES COc1cc(Cl)c(cc1NC(=S)N1CCC(CC1)(O)c1cccc(c1)C(F)(F)F)OC
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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 C21H22ClF3N2O3S MW 474.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClF3N2O3S/c1-29-17-12-16(18(30-2)11-15(17)22)26-19(31)27-8-6-20(28,7-9-27)13-4-3-5-14(10-13)21(23,24)25/h3-5,10-12,28H,6-9H2,1-2H3,(H,26,31)InChIKey
XELAGLKPWVQIGJ-UHFFFAOYSA-NSynonyms
1(((4CHLORO25DIMETHOXYPHENYL)AMINO)THIOXOMETHYL)4(3(TRIFLUOROMETHYL)PHENYL)PIPERIDIN4OL
COC1=CC(=C(C=C1NC(=S)N2CCC(CC2)(C3=CC(=CC=C3)C(F)(F)F)O)OC)Cl
InChI=1SC21H22ClF3N2O3Sc129171216(18(302)1115(17)22)2619(31)278620(287927)1343514(1013)21(2324)25h35101228H69H212H3(H2631)
MFCD06631316
N(4chloro25dimethoxyphenyl)4hydroxy4(3(trifluoromethyl)phenyl)piperidine1carbothioamide
ZINC000002886063
ZINC02886063
ZINC2886063
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