Vitas-M small molecule compound
N-{2-[5-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide
Catalog ID
STK336206
SMILES C=CCn1c(CCNC(=O)c2ccccc2F)nnc1SCC(=O)c1ccc(cc1Cl)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 C22H19Cl2FN4O2S MW 493.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2FN4O2S/c1-2-11-29-20(9-10-26-21(31)16-5-3-4-6-18(16)25)27-28-22(29)32-13-19(30)15-8-7-14(23)12-17(15)24/h2-8,12H,1,9-11,13H2,(H,26,31)InChIKey
YRBKJJWHPHVMOF-UHFFFAOYSA-NSynonyms
C=CCN1C(=NN=C1SCC(=O)C2=C(C=C(C=C2)Cl)Cl)CCNC(=O)C3=CC=CC=C3F
InChI=1SC22H19Cl2FN4O2Sc12112920(9102621(31)16534618(16)25)272822(29)321319(30)158714(23)1217(15)24h2812H191113H2(H2631)
MFCD09964579
N(2(5((2(24DICHLOROPHENYL)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(2(5(2(24dichlorophenyl)2oxoethyl)sulfanyl4prop2enyl124triazol3yl)ethyl)2fluorobenzamide
ZINC000018201304
ZINC18201304
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