Vitas-M small molecule compound
4-{[(E)-{5-[(3-chloro-4-fluorophenoxy)methyl]furan-2-yl}methylidene]amino}-5-methyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173208
SMILES Clc1cc(OCc2ccc(o2)/C=N/n2c(C)nnc2S)ccc1F
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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 C15H12ClFN4O2S MW 366.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClFN4O2S/c1-9-19-20-15(24)21(9)18-7-11-2-3-12(23-11)8-22-10-4-5-14(17)13(16)6-10/h2-7H,8H2,1H3,(H,20,24)/b18-7+InChIKey
XLBQTKJKEXNCDP-CNHKJKLMSA-NSynonyms
866736-45-04(((E)(5((3chloro4fluorophenoxy)methyl)furan2yl)methylidene)amino)5methyl4H124triazole3thiol
4((E)(5((3chloro4fluorophenoxy)methyl)furan2yl)methylideneamino)3methyl1H124triazole5thione
866736450
CC1=NNC(=S)N1N=CC2=CC=C(O2)COC3=CC(=C(C=C3)F)Cl
Clc1cc(OCc2ccc(o2)C=Nn2c(C)nnc2S)ccc1F
InChI=1SC15H12ClFN4O2Sc19192015(24)21(9)187112312(2311)822104514(17)13(16)610h27H8H21H3(H2024)b187+
MFCD06195869
ZINC000036611338
ZINC96569430
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