Vitas-M small molecule compound
4-{[(E)-{5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-yl}methylidene]amino}-5-methyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173213
SMILES Cc1cc(OCc2ccc(o2)/C=N/n2c(C)nnc2S)cc(c1Cl)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 C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-10-6-15(7-11(2)16(10)18)23-9-14-5-4-13(24-14)8-19-22-12(3)20-21-17(22)25/h4-8H,9H2,1-3H3,(H,21,25)/b19-8+InChIKey
BKHGKTWULKUKNA-UFWORHAWSA-NSynonyms
866564-25-24(((E)(5((4chloro35dimethylphenoxy)methyl)furan2yl)methylidene)amino)5methyl4H124triazole3thiol
4((E)(5((4chloro35dimethylphenoxy)methyl)furan2yl)methylideneamino)3methyl1H124triazole5thione
866564252
CC1=CC(=CC(=C1Cl)C)OCC2=CC=C(O2)C=NN3C(=NNC3=S)C
Cc1cc(OCc2ccc(o2)C=Nn2c(C)nnc2S)cc(c1Cl)C
InChI=1SC17H17ClN4O2Sc110615(711(2)16(10)18)239145413(2414)8192212(3)202117(22)25h48H9H213H3(H2125)b198+
MFCD06195861
ZINC000036611334
ZINC96569486
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