Vitas-M small molecule compound
N-[(E)-{5-[(2,6-dichlorophenoxy)methyl]furan-2-yl}methylidene]-3-(ethylsulfanyl)-5-(furan-2-yl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173517
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1c(Cl)cccc1Cl)c1ccco1
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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 C20H16Cl2N4O3S MW 463.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2N4O3S/c1-2-30-20-25-24-19(17-7-4-10-27-17)26(20)23-11-13-8-9-14(29-13)12-28-18-15(21)5-3-6-16(18)22/h3-11H,2,12H2,1H3/b23-11+InChIKey
YETRJMKVRSELNQ-FOKLQQMPSA-NSynonyms
866738-71-8(E)1(5((26dichlorophenoxy)methyl)furan2yl)N(3ethylsulfanyl5(furan2yl)124triazol4yl)methanimine
866738718
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C=CC=C3Cl)Cl)C4=CC=CO4
CCSc1nnc(n1N=Cc1ccc(o1)COc1c(Cl)cccc1Cl)c1ccco1
InChI=1SC20H16Cl2N4O3Sc123020252419(1774102717)26(20)2311138914(2913)12281815(21)53616(18)22h311H212H21H3b2311+
MFCD07433962
N((E)(5((26dichlorophenoxy)methyl)furan2yl)methylidene)3(ethylsulfanyl)5(furan2yl)4H124triazol4amine
ZINC000036611425
ZINC96577055
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