Vitas-M small molecule compound
4-{[(E)-{5-[(4-chlorophenoxy)methyl]furan-2-yl}methylidene]amino}-5-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173349
SMILES CCc1nnc(n1/N=C/c1ccc(o1)COc1ccc(cc1)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 C16H15ClN4O2S MW 362.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4O2S/c1-2-15-19-20-16(24)21(15)18-9-13-7-8-14(23-13)10-22-12-5-3-11(17)4-6-12/h3-9H,2,10H2,1H3,(H,20,24)/b18-9+InChIKey
QDCAHTHAEOQOPH-GIJQJNRQSA-NSynonyms
866564-17-24(((E)(5((4chlorophenoxy)methyl)furan2yl)methylidene)amino)5ethyl4H124triazole3thiol
4((E)(5((4chlorophenoxy)methyl)furan2yl)methylideneamino)3ethyl1H124triazole5thione
866564172
CCC1=NNC(=S)N1N=CC2=CC=C(O2)COC3=CC=C(C=C3)Cl
CCc1nnc(n1N=Cc1ccc(o1)COc1ccc(cc1)Cl)S
InChI=1SC16H15ClN4O2Sc1215192016(24)21(15)189137814(2313)1022125311(17)4612h39H210H21H3(H2024)b189+
MFCD06195850
ZINC000036611327
ZINC96569401
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