Vitas-M small molecule compound

([(2-methylbenzyl)sulfanyl]{[3-(trifluoromethyl)phenyl]amino}methylidene)propanedinitrile

Catalog ID
STK581961
SMILES N#CC(=C(Nc1cccc(c1)C(F)(F)F)SCc1ccccc1C)C#N

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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 C19H14F3N3S MW 373.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14F3N3S/c1-13-5-2-3-6-14(13)12-26-18(15(10-23)11-24)25-17-8-4-7-16(9-17)19(20,21)22/h2-9,25H,12H2,1H3
InChIKey
CYXBVMUVUXNMRM-UHFFFAOYSA-N
Synonyms
497243-45-5
(((2methylbenzyl)sulfanyl)((3(trifluoromethyl)phenyl)amino)methylidene)propanedinitrile
2(((2methylbenzyl)thio)((3(trifluoromethyl)phenyl)amino)methylene)malononitrile
2((2METHYLPHENYL)METHYLSULFANYL(3(TRIFLUOROMETHYL)ANILINO)METHYLIDENE)PROPANEDINITRILE
497243455
CC1=CC=CC=C1CSC(=C(C#N)C#N)NC2=CC=CC(=C2)C(F)(F)F
InChI=1SC19H14F3N3Sc113523614(13)122618(15(1023)1124)251784716(917)19(2021)22h2925H12H21H3
MFCD03300244
ZINC000002341159
ZINC02341159
ZINC2341159

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Available files

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