Vitas-M small molecule compound
5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK946062
SMILES COc1cc(CCc2nnc(n2c2ccccc2OC)S)ccc1OC
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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 C19H21N3O3S MW 371.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O3S/c1-23-15-7-5-4-6-14(15)22-18(20-21-19(22)26)11-9-13-8-10-16(24-2)17(12-13)25-3/h4-8,10,12H,9,11H2,1-3H3,(H,21,26)InChIKey
OALCHCMMPSRWMX-UHFFFAOYSA-NSynonyms
942876-55-33(2(34dimethoxyphenyl)ethyl)4(2methoxyphenyl)1H124triazole5thione
5(2(34dimethoxyphenyl)ethyl)4(2methoxyphenyl)4H124triazole3thiol
942876553
COC1=C(C=C(C=C1)CCC2=NNC(=S)N2C3=CC=CC=C3OC)OC
InChI=1SC19H21N3O3Sc12315754614(15)2218(202119(22)26)1191381016(242)17(1213)253h481012H911H213H3(H2126)
MFCD09983432
ZINC000011692623
ZINC11692623
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