Vitas-M small molecule compound
N-[(E)-{5-[(3,4-dichlorophenoxy)methyl]furan-2-yl}methylidene]-3-(ethylsulfanyl)-5-(furan-2-yl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173476
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1ccc(c(c1)Cl)Cl)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(18-4-3-9-27-18)26(20)23-11-14-5-6-15(29-14)12-28-13-7-8-16(21)17(22)10-13/h3-11H,2,12H2,1H3/b23-11+InChIKey
ADNQMSMOLCCYTA-FOKLQQMPSA-NSynonyms
866564-22-9(E)1(5((34dichlorophenoxy)methyl)furan2yl)N(3ethylsulfanyl5(furan2yl)124triazol4yl)methanimine
866564229
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=CC(=C(C=C3)Cl)Cl)C4=CC=CO4
CCSc1nnc(n1N=Cc1ccc(o1)COc1ccc(c(c1)Cl)Cl)c1ccco1
InChI=1SC20H16Cl2N4O3Sc123020252419(184392718)26(20)2311145615(2914)1228137816(21)17(22)1013h311H212H21H3b2311+
MFCD06195856
N((E)(5((34dichlorophenoxy)methyl)furan2yl)methylidene)3(ethylsulfanyl)5(furan2yl)4H124triazol4amine
ZINC000020617960
ZINC96577621
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