Vitas-M small molecule compound
1-(azepan-1-yl)-2-{[4-hydroxy-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethanone
Catalog ID
STL406991
SMILES Oc1nc(SCC(=O)N2CCCCCC2)nc(c1)C(F)(F)F
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C13H16F3N3O2S MW 335.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16F3N3O2S/c14-13(15,16)9-7-10(20)18-12(17-9)22-8-11(21)19-5-3-1-2-4-6-19/h7H,1-6,8H2,(H,17,18,20)InChIKey
RIGAOYLBPBETLP-UHFFFAOYSA-NSynonyms
899990-70-61(azepan1yl)2((4hydroxy6(trifluoromethyl)pyrimidin2yl)sulfanyl)ethanone
2((2(AZEPAN1YL)2OXOETHYL)THIO)6(TRIFLUOROMETHYL)PYRIMIDIN4(3H)ONE
2(2(AZEPAN1YL)2OXOETHYL)SULFANYL6(TRIFLUOROMETHYL)1HPYRIMIDIN4ONE
899990706
C1CCCN(CC1)C(=O)CSC2=NC(=O)C=C(N2)C(F)(F)F
InChI=1SC13H16F3N3O2Sc1413(1516)9710(20)1812(179)22811(21)1953124619h7H168H2(H171820)
MFCD30704619
ZINC000005155049
ZINC05155049
ZINC5155049
Check stock
See real-time availability and sample size for STL406991 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.