Vitas-M small molecule compound
5-(3,4-diethoxybenzyl)-4-(2,4-difluorophenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448343
SMILES CCOc1cc(ccc1OCC)Cc1nnc(n1c1ccc(cc1F)F)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/c1-3-25-16-8-5-12(9-17(16)26-4-2)10-18-22-23-19(27)24(18)15-7-6-13(20)11-14(15)21/h5-9,11H,3-4,10H2,1-2H3,(H,23,27)InChIKey
YHZUPIYPYMSANN-UHFFFAOYSA-NSynonyms
3((34diethoxyphenyl)methyl)4(24difluorophenyl)1H124triazole5thione
5((34DIETHOXYPHENYL)METHYL)4(24DIFLUOROPHENYL)124TRIAZOLE3THIOL
5(34diethoxybenzyl)4(24difluorophenyl)4H124triazole3thiol
CCOC1=C(C=C(C=C1)CC2=NNC(=S)N2C3=C(C=C(C=C3)F)F)OCC
InChI=1SC19H19F2N3O2Sc1325168512(917(16)2642)1018222319(27)24(18)157613(20)1114(15)21h5911H3410H212H3(H2327)
MFCD04140212
ZINC000006242743
ZINC06242743
ZINC6242743
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