Vitas-M small molecule compound
1-(3-{[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanoyl)piperidine-4-carboxamide
Catalog ID
STK339128
SMILES O=C(N1CCC(CC1)C(=O)N)CCSc1nc(cc(n1)C(F)(F)F)c1ccc2c(c1)OCO2
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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 C21H21F3N4O4S MW 482.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N4O4S/c22-21(23,24)17-10-14(13-1-2-15-16(9-13)32-11-31-15)26-20(27-17)33-8-5-18(29)28-6-3-12(4-7-28)19(25)30/h1-2,9-10,12H,3-8,11H2,(H2,25,30)InChIKey
IBDJLRMGAIDPHS-UHFFFAOYSA-NSynonyms
510710-48-21(3((4(13BENZODIOXOL5YL)6(TRIFLUOROMETHYL)2PYRIMIDINYL)SULFANYL)PROPANOYL)4PIPERIDINECARBOXAMIDE
1(3((4(13benzodioxol5yl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)propanoyl)piperidine4carboxamide
1(3((4(BENZO(D)(13)DIOXOL5YL)6(TRIFLUOROMETHYL)PYRIMIDIN2YL)THIO)PROPANOYL)PIPERIDINE4CARBOXAMIDE
1(3(4(13benzodioxol5yl)6(trifluoromethyl)pyrimidin2yl)sulfanylpropanoyl)piperidine4carboxamide
1(3(4(2HBENZO(34D)13DIOXOLEN5YL)6(TRIFLUOROMETHYL)PYRIMIDIN2YLTHIO)PROPANOYL)PIPERIDINE4CARBOXAMIDE
510710482
C1CN(CCC1C(=O)N)C(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC4=C(C=C3)OCO4
InChI=1SC21H21F3N4O4Sc2221(2324)171014(13121516(913)32113115)2620(2717)338518(29)286312(4728)19(25)30h1291012H3811H2(H22530)
MFCD03043173
ZINC000000920093
ZINC00920093
ZINC920093
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.