Vitas-M small molecule compound
5-(3,4-diethoxybenzyl)-4-(2-ethylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK421857
SMILES CCOc1cc(ccc1OCC)Cc1nnc(n1c1ccccc1CC)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 C21H25N3O2S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S/c1-4-16-9-7-8-10-17(16)24-20(22-23-21(24)27)14-15-11-12-18(25-5-2)19(13-15)26-6-3/h7-13H,4-6,14H2,1-3H3,(H,23,27)InChIKey
AAXPVUZPTVKFEH-UHFFFAOYSA-NSynonyms
828291-51-63((34DIETHOXYPHENYL)METHYL)4(2ETHYLPHENYL)1H124TRIAZOLE5THIONE
5(34diethoxybenzyl)4(2ethylphenyl)4H124triazole3thiol
828291516
CCC1=CC=CC=C1N2C(=NNC2=S)CC3=CC(=C(C=C3)OCC)OCC
InChI=1SC21H25N3O2Sc14169781017(16)2420(222321(24)27)1415111218(2552)19(1315)2663h713H4614H213H3(H2327)
MFCD04052716
ZINC000006910858
ZINC6910858
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