Vitas-M small molecule compound

6-phenyl-2-thioxo-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile

Catalog ID
STL323952
SMILES N#Cc1c(=S)[nH]c(cc1C(F)(F)F)c1ccccc1

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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 C13H7F3N2S MW 280.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7F3N2S/c14-13(15,16)10-6-11(8-4-2-1-3-5-8)18-12(19)9(10)7-17/h1-6H,(H,18,19)
InChIKey
HZBJUXYKUJPFFA-UHFFFAOYSA-N
Synonyms
104960-49-8
104960498
2MERCAPTO6PHENYL4(TRIFLUOROMETHYL)NICOTINONITRILE
3CYANO6PHENYL4(TRIFLUOROMETHYL)PYRIDINE2THIOL
3PYRIDINECARBONITRILE12DIHYDRO6PHENYL2THIOXO4(TRIFLUOROMETHYL)
6PHENYL2SULFANYL4(TRIFLUOROMETHYL)PYRIDINE3CARBONITRILE
6PHENYL2SULFANYLIDENE4(TRIFLUOROMETHYL)12DIHYDROPYRIDINE3CARBONITRILE
6PHENYL2SULFANYLIDENE4(TRIFLUOROMETHYL)1HPYRIDINE3CARBONITRILE
6PHENYL2THIOXO4(TRIFLUOROMETHYL)12DIHYDRO3PYRIDINECARBONITRILE
6phenyl2thioxo4(trifluoromethyl)12dihydropyridine3carbonitrile
6PHENYL2THIOXO4(TRIFLUOROMETHYL)HYDROPYRIDINE3CARBONITRILE
C1=CC=C(C=C1)C2=CC(=C(C(=S)N2)C#N)C(F)(F)F
InChI=1SC13H7F3N2Sc1413(1516)10611(8421358)1812(19)9(10)717h16H(H1819)
MFCD00430025
N#Cc1c(=S)(nH)c(cc1C(F)(F)F)c1ccccc1
ZINC000000031210
ZINC31210

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Available files

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