Vitas-M small molecule compound
4-benzyl-5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307464
SMILES CCOc1cc(ccc1OC(F)F)c1nnc(n1Cc1ccccc1)S
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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 C18H17F2N3O2S MW 377.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F2N3O2S/c1-2-24-15-10-13(8-9-14(15)25-17(19)20)16-21-22-18(26)23(16)11-12-6-4-3-5-7-12/h3-10,17H,2,11H2,1H3,(H,22,26)InChIKey
XUYABSRCWAIPKB-UHFFFAOYSA-NSynonyms
828292-40-64BENZYL3(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)1H124TRIAZOLE5THIONE
4benzyl5(4(difluoromethoxy)3ethoxyphenyl)4H124triazole3thiol
5(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)4BENZYL124TRIAZOLE3THIOL
828292406
CCOC1=C(C=CC(=C1)C2=NNC(=S)N2CC3=CC=CC=C3)OC(F)F
InChI=1SC18H17F2N3O2Sc1224151013(8914(15)2517(19)20)16212218(26)23(16)11126435712h31017H211H21H3(H2226)
MFCD04056728
ZINC000008477918
ZINC8477918
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