Vitas-M small molecule compound
2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Catalog ID
STL307977
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)N/N=C/c1ccccc1C(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 C25H26F3N5OS MW 501.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26F3N5OS/c1-17-11-13-18(14-12-17)23-31-32-24(33(23)20-8-3-2-4-9-20)35-16-22(34)30-29-15-19-7-5-6-10-21(19)25(26,27)28/h5-7,10-15,20H,2-4,8-9,16H2,1H3,(H,30,34)/b29-15+InChIKey
AFNBJXILNRQJDZ-WKULSOCRSA-NSynonyms
497169-31-0(E)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)N(2(trifluoromethyl)benzylidene)acetohydrazide
2((4cyclohexyl5(4methylphenyl)124triazol3yl)sulfanyl)N((E)(2(trifluoromethyl)phenyl)methylideneamino)acetamide
2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)(2(trifluoromethyl)phenyl)methylidene)acetohydrazide
497169310
CC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)NN=CC4=CC=CC=C4C(F)(F)F
InChI=1SC25H26F3N5OSc117111318(141217)23313224(33(23)208324920)351622(34)302915197561021(19)25(2627)28h57101520H248916H21H3(H3034)b2915+
MFCD03222443
N((1E)2(2(TRIFLUOROMETHYL)PHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000013662121
ZINC101422130
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