Vitas-M small molecule compound
5-[1-(2,5-dichlorophenoxy)ethyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK502658
SMILES CCn1c(S)nnc1C(Oc1cc(Cl)ccc1Cl)C
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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 C12H13Cl2N3OS MW 318.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13Cl2N3OS/c1-3-17-11(15-16-12(17)19)7(2)18-10-6-8(13)4-5-9(10)14/h4-7H,3H2,1-2H3,(H,16,19)InChIKey
JJNBPDHHRSAYDG-UHFFFAOYSA-NSynonyms
862655-04-73(1(25dichlorophenoxy)ethyl)4ethyl1H124triazole5thione
5(1(25DICHLOROPHENOXY)ETHYL)4ETHYL124TRIAZOLE3THIOL
5(1(25DICHLOROPHENOXY)ETHYL)4ETHYL4H124TRIAZOLE3THIOL
862655047
CCN1C(=NNC1=S)C(C)OC2=C(C=CC(=C2)Cl)Cl
InChI=1SC12H13Cl2N3OSc131711(151612(17)19)7(2)181068(13)459(10)14h47H3H212H3(H1619)
MFCD04968910
ZINC000002536750
ZINC000015933428
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