Vitas-M small molecule compound
2-[4-ethyl-5-({2-[(4-fluoro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK498160
SMILES CCn1c(SCC(=O)Nc2ccc(cc2C)F)nnc1CC(=O)Nc1cccc(c1)C(F)(F)F
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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 C22H21F4N5O2S MW 495.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F4N5O2S/c1-3-31-18(11-19(32)27-16-6-4-5-14(10-16)22(24,25)26)29-30-21(31)34-12-20(33)28-17-8-7-15(23)9-13(17)2/h4-10H,3,11-12H2,1-2H3,(H,27,32)(H,28,33)InChIKey
JZDJZBNHDCJPDE-UHFFFAOYSA-NSynonyms
2(4ethyl5((2((4fluoro2methylphenyl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)N(3(trifluoromethyl)phenyl)acetamide
2(4ethyl5(2(4fluoro2methylanilino)2oxoethyl)sulfanyl124triazol3yl)N(3(trifluoromethyl)phenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)F)C)CC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC22H21F4N5O2Sc133118(1119(32)271664514(1016)22(2425)26)293021(31)341220(33)28178715(23)913(17)2h410H31112H212H3(H2732)(H2833)
MFCD11855327
ZINC000032579591
ZINC32579591
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