Vitas-M small molecule compound
2-[(4-ethyl-5-{2-[(4-methylphenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK297734
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)C(F)(F)F)nnc1CC(=O)Nc1ccc(cc1)C
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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 C22H22F3N5O2S MW 477.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F3N5O2S/c1-3-30-18(12-19(31)26-16-8-4-14(2)5-9-16)28-29-21(30)33-13-20(32)27-17-10-6-15(7-11-17)22(23,24)25/h4-11H,3,12-13H2,1-2H3,(H,26,31)(H,27,32)InChIKey
NCTBCKDBUMHYTI-UHFFFAOYSA-NSynonyms
2((4ethyl5(2((4methylphenyl)amino)2oxoethyl)4H124triazol3yl)sulfanyl)N(4(trifluoromethyl)phenyl)acetamide
2(4ETHYL5((4TRIFLUOROMETHYLPHENYLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YL)NPTOLYLACETAMIDE
2(4ethyl5(2oxo2(4(trifluoromethyl)anilino)ethyl)sulfanyl124triazol3yl)N(4methylphenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(F)(F)F)CC(=O)NC3=CC=C(C=C3)C
InChI=1SC22H22F3N5O2Sc133018(1219(31)26168414(2)5916)282921(30)331320(32)271710615(71117)22(2324)25h411H31213H212H3(H2631)(H2732)
MFCD09961128
ZINC000013956605
ZINC13956605
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