Vitas-M small molecule compound
4-{[(E)-{5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}methylidene]amino}-5-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173225
SMILES CCc1nnc(n1/N=C/c1ccc(o1)COc1cccc(c1Cl)Cl)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 C16H14Cl2N4O2S MW 397.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14Cl2N4O2S/c1-2-14-20-21-16(25)22(14)19-8-10-6-7-11(24-10)9-23-13-5-3-4-12(17)15(13)18/h3-8H,2,9H2,1H3,(H,21,25)/b19-8+InChIKey
ZKKWBRPYGBRDFH-UFWORHAWSA-NSynonyms
866738-29-64(((E)(5((23dichlorophenoxy)methyl)furan2yl)methylidene)amino)5ethyl4H124triazole3thiol
4((E)(5((23dichlorophenoxy)methyl)furan2yl)methylideneamino)3ethyl1H124triazole5thione
866738296
CCC1=NNC(=S)N1N=CC2=CC=C(O2)COC3=C(C(=CC=C3)Cl)Cl
CCc1nnc(n1N=Cc1ccc(o1)COc1cccc(c1Cl)Cl)S
InChI=1SC16H14Cl2N4O2Sc1214202116(25)22(14)198106711(2410)9231353412(17)15(13)18h38H29H21H3(H2125)b198+
MFCD06195972
ZINC000036611405
ZINC96569633
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