Vitas-M small molecule compound
4-({[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)benzonitrile
Catalog ID
STK278644
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)C#N)nnc1c1ccccc1F
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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 C20H15FN4OS MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN4OS/c1-2-11-25-19(16-5-3-4-6-17(16)21)23-24-20(25)27-13-18(26)15-9-7-14(12-22)8-10-15/h2-10H,1,11,13H2InChIKey
BQUPUSXGFKDFDW-UHFFFAOYSA-NSynonyms
4(((5(2FLUOROPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETYL)BENZONITRILE
4(2((5(2fluorophenyl)4prop2enyl124triazol3yl)sulfanyl)acetyl)benzonitrile
4(2(4ALLYL5(2FLUOROPHENYL)4H(124)TRIAZOL3YLSULFANYL)ACETYL)BENZONITRILE
C=CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)C3=CC=CC=C3F
InChI=1SC20H15FN4OSc12112519(16534617(16)21)232420(25)271318(26)159714(1222)81015h210H11113H2
MFCD09269431
ZINC000009095785
ZINC09095785
ZINC9095785
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