Vitas-M small molecule compound
3-[5-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-N-(2-fluorophenyl)propanamide
Catalog ID
STK231284
SMILES COc1ccc(cc1NC(=O)CSc1nnc(n1CC)CCC(=O)Nc1ccccc1F)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 C22H23ClFN5O3S MW 491.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClFN5O3S/c1-3-29-19(10-11-20(30)25-16-7-5-4-6-15(16)24)27-28-22(29)33-13-21(31)26-17-12-14(23)8-9-18(17)32-2/h4-9,12H,3,10-11,13H2,1-2H3,(H,25,30)(H,26,31)InChIKey
CNJABRHJSCBJQC-UHFFFAOYSA-NSynonyms
3(5((2((5chloro2methoxyphenyl)amino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)N(2fluorophenyl)propanamide
3(5(2(5CHLORO2METHOXYANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(2FLUOROPHENYL)PROPANAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)OC)CCC(=O)NC3=CC=CC=C3F
InChI=1SC22H23ClFN5O3Sc132919(101120(30)2516754615(16)24)272822(29)331321(31)26171214(23)8918(17)322h4912H3101113H212H3(H2530)(H2631)
MFCD07358928
ZINC000009304315
ZINC09304315
ZINC9304315
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