Vitas-M small molecule compound

[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone

Catalog ID
STK612499
SMILES CSc1ncc(c(n1)C(=O)N1CCN(CC1)c1ccccc1F)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 C16H16ClFN4OS MW 366.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClFN4OS/c1-24-16-19-10-11(17)14(20-16)15(23)22-8-6-21(7-9-22)13-5-3-2-4-12(13)18/h2-5,10H,6-9H2,1H3
InChIKey
GFMPDGRYEFDEPW-UHFFFAOYSA-N
Synonyms
889305-66-2
(5chloro2(methylsulfanyl)pyrimidin4yl)(4(2fluorophenyl)piperazin1yl)methanone
(5chloro2(methylthio)pyrimidin4yl)(4(2fluorophenyl)piperazin1yl)methanone
(5CHLORO2METHYLSULFANYLPYRIMIDIN4YL)(4(2FLUOROPHENYL)PIPERAZIN1YL)METHANONE
889305662
CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3F)Cl
InChI=1SC16H16ClFN4OSc12416191011(17)14(2016)15(23)228621(7922)13532412(13)18h2510H69H21H3
MFCD08070451
ZINC000006669466
ZINC06669466
ZINC6669466

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.