Vitas-M small molecule compound
4-butyl-5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173898
SMILES CCCCn1c(S)nnc1c1ccc(c(c1)OCC)OC(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 C15H19F2N3O2S MW 343.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19F2N3O2S/c1-3-5-8-20-13(18-19-15(20)23)10-6-7-11(22-14(16)17)12(9-10)21-4-2/h6-7,9,14H,3-5,8H2,1-2H3,(H,19,23)InChIKey
LZRMNSQKMRFXJB-UHFFFAOYSA-NSynonyms
828290-91-14BUTYL3(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)1H124TRIAZOLE5THIONE
4butyl5(4(difluoromethoxy)3ethoxyphenyl)4H124triazole3thiol
828290911
CCCCN1C(=NNC1=S)C2=CC(=C(C=C2)OC(F)F)OCC
InChI=1SC15H19F2N3O2Sc13582013(181915(20)23)106711(2214(16)17)12(910)2142h67914H358H212H3(H1923)
MFCD04056651
ZINC000006890885
ZINC06890885
ZINC6890885
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