Vitas-M small molecule compound
5-phenyl-4-{[(E)-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK509198
SMILES Sc1nnc(n1/N=C/c1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccccc1
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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 C20H13F3N4OS MW 414.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13F3N4OS/c21-20(22,23)15-8-4-7-14(11-15)17-10-9-16(28-17)12-24-27-18(25-26-19(27)29)13-5-2-1-3-6-13/h1-12H,(H,26,29)/b24-12+InChIKey
UCZIVGZZGRZIKW-WYMPLXKRSA-NSynonyms
3PHENYL4((E)(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
5PHENYL4(((5(3(TRIFLUOROMETHYL)PHENYL)2FURYL)METHYLENE)AMINO)4H124TRIAZOL3YLHYDROSULFIDE
5phenyl4(((E)(5(3(trifluoromethyl)phenyl)furan2yl)methylidene)amino)4H124triazole3thiol
C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F
InChI=1SC20H13F3N4OSc2120(2223)1584714(1115)1710916(2817)12242718(252619(27)29)135213613h112H(H2629)b2412+
MFCD02222432
Sc1nnc(n1N=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccccc1
ZINC000002094830
ZINC33348332
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