Vitas-M small molecule compound
2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(Z)-[2-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Catalog ID
STK108234
SMILES CCn1c(SCC(=O)N/N=C\c2ccccc2C(F)(F)F)nnc1c1ccc(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 C21H20F3N5OS MW 447.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5OS/c1-3-29-19(15-10-8-14(2)9-11-15)27-28-20(29)31-13-18(30)26-25-12-16-6-4-5-7-17(16)21(22,23)24/h4-12H,3,13H2,1-2H3,(H,26,30)/b25-12-InChIKey
BJZIXTMCUPATNT-ROTLSHHCSA-NSynonyms
2((4ETHYL5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((Z)(2(TRIFLUOROMETHYL)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4ETHYL5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((Z)(2(TRIFLUOROMETHYL)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2C(F)(F)F)C3=CC=C(C=C3)C
CCn1c(SCC(=O)NN=Cc2ccccc2C(F)(F)F)nnc1c1ccc(cc1)C
InChI=1SC21H20F3N5OSc132919(1510814(2)91115)272820(29)311318(30)26251216645717(16)21(2223)24h412H313H212H3(H2630)b2512
MFCD03219589
ZINC000030750207
ZINC1474367
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