Vitas-M small molecule compound
4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL055446
SMILES Cc1[nH]nc(c1)c1nnc(n1/N=C/c1c(F)cccc1Cl)S
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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 C13H10ClFN6S MW 336.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10ClFN6S/c1-7-5-11(18-17-7)12-19-20-13(22)21(12)16-6-8-9(14)3-2-4-10(8)15/h2-6H,1H3,(H,17,18)(H,20,22)/b16-6+InChIKey
NYQIURRGFKPLNV-OMCISZLKSA-NSynonyms
1042675-43-3(E)4((2chloro6fluorobenzylidene)amino)5(3methyl1Hpyrazol5yl)4H124triazole3thiol
1042675433
4(((E)(2chloro6fluorophenyl)methylidene)amino)5(5methyl1Hpyrazol3yl)4H124triazole3thiol
4((E)(2CHLORO6FLUOROPHENYL)METHYLIDENEAMINO)3(5METHYL1HPYRAZOL3YL)1H124TRIAZOLE5THIONE
Cc1(nH)nc(c1)c1nnc(n1N=Cc1c(F)cccc1Cl)S
CC1=CC(=NN1)C2=NNC(=S)N2N=CC3=C(C=CC=C3Cl)F
Cc1n(nH)c(c1)c1nnc(n1N=Cc1c(F)cccc1Cl)S
InChI=1SC13H10ClFN6Sc17511(18177)12192013(22)21(12)16689(14)32410(8)15h26H1H3(H1718)(H2022)b166+
MFCD05732941
ZINC000006786012
ZINC8576606
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