Vitas-M small molecule compound
N-[(E)-{5-[(2,5-dichlorophenoxy)methyl]furan-2-yl}methylidene]-3-(propylsulfanyl)-5-(trifluoromethyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL178776
SMILES CCCSc1nnc(n1/N=C/c1ccc(o1)COc1cc(Cl)ccc1Cl)C(F)(F)F
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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 C18H15Cl2F3N4O2S MW 479.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl2F3N4O2S/c1-2-7-30-17-26-25-16(18(21,22)23)27(17)24-9-12-4-5-13(29-12)10-28-15-8-11(19)3-6-14(15)20/h3-6,8-9H,2,7,10H2,1H3/b24-9+InChIKey
ZCYRIWHOKJKPPW-PGGKNCGUSA-NSynonyms
(E)1(5((25dichlorophenoxy)methyl)furan2yl)N(3propylsulfanyl5(trifluoromethyl)124triazol4yl)methanimine
CCCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C=CC(=C3)Cl)Cl)C(F)(F)F
CCCSc1nnc(n1N=Cc1ccc(o1)COc1cc(Cl)ccc1Cl)C(F)(F)F
InChI=1SC18H15Cl2F3N4O2Sc1273017262516(18(2122)23)27(17)249124513(2912)102815811(19)3614(15)20h3689H2710H21H3b249+
MFCD08553378
N((E)(5((25dichlorophenoxy)methyl)furan2yl)methylidene)3(propylsulfanyl)5(trifluoromethyl)4H124triazol4amine
ZINC000036611923
ZINC96577129
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