Vitas-M small molecule compound
5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-(2,5-dimethylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173951
SMILES CCOc1cc(ccc1OC(F)F)c1nnc(n1c1cc(C)ccc1C)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 C19H19F2N3O2S MW 391.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19F2N3O2S/c1-4-25-16-10-13(7-8-15(16)26-18(20)21)17-22-23-19(27)24(17)14-9-11(2)5-6-12(14)3/h5-10,18H,4H2,1-3H3,(H,23,27)InChIKey
JZTDRWGRBOXIEY-UHFFFAOYSA-NSynonyms
828286-68-63(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)4(25DIMETHYLPHENYL)1H124TRIAZOLE5THIONE
5(4(difluoromethoxy)3ethoxyphenyl)4(25dimethylphenyl)4H124triazole3thiol
828286686
CCOC1=C(C=CC(=C1)C2=NNC(=S)N2C3=C(C=CC(=C3)C)C)OC(F)F
InChI=1SC19H19F2N3O2Sc1425161013(7815(16)2618(20)21)17222319(27)24(17)14911(2)5612(14)3h51018H4H213H3(H2327)
MFCD04130344
ZINC000002792287
ZINC02792287
ZINC2792287
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