Vitas-M small molecule compound

3-{[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-cyclopentylpropanamide

Catalog ID
STK339512
SMILES O=C(NC1CCCC1)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 C20H20F3N3O3S MW 439.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N3O3S/c21-20(22,23)17-10-14(12-5-6-15-16(9-12)29-11-28-15)25-19(26-17)30-8-7-18(27)24-13-3-1-2-4-13/h5-6,9-10,13H,1-4,7-8,11H2,(H,24,27)
InChIKey
NFJFRLRPDNDMMV-UHFFFAOYSA-N
Synonyms
510710-17-5
3((4(13benzodioxol5yl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)Ncyclopentylpropanamide
3(4(13benzodioxol5yl)6(trifluoromethyl)pyrimidin2yl)sulfanylNcyclopentylpropanamide
3(4(2HBENZO(34D)13DIOXOLEN5YL)6(TRIFLUOROMETHYL)PYRIMIDIN2YLTHIO)NCYCLOPENTYLPROPANAMIDE
510710175
C1CCC(C1)NC(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC4=C(C=C3)OCO4
InChI=1SC20H20F3N3O3Sc2120(2223)171014(12561516(912)29112815)2519(2617)308718(27)2413312413h5691013H147811H2(H2427)
MFCD03044250
ZINC000000920025
ZINC00920025
ZINC920025

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Available files

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