Vitas-M small molecule compound
4-(2,5-dimethoxyphenyl)-5-[(2R)-2-phenylcyclopropyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL147581
SMILES COc1ccc(c(c1)n1c(=S)[nH]nc1C1C[C@H]1c1ccccc1)OC
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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 C19H19N3O2S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S/c1-23-13-8-9-17(24-2)16(10-13)22-18(20-21-19(22)25)15-11-14(15)12-6-4-3-5-7-12/h3-10,14-15H,11H2,1-2H3,(H,21,25)/t14-,15?/m0/s1InChIKey
NEBYJBFRHVAACI-MLCCFXAWSA-NSynonyms
4(25dimethoxyphenyl)3((2R)2phenylcyclopropyl)1H124triazole5thione
4(25dimethoxyphenyl)5((2R)2phenylcyclopropyl)24dihydro3H124triazole3thione
COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)C3CC3C4=CC=CC=C4
COc1ccc(c(c1)n1c(=S)(nH)nc1C1C(C@H)1c1ccccc1)OC
InChI=1SC19H19N3O2Sc123138917(242)16(1013)2218(202119(22)25)151114(15)126435712h3101415H11H212H3(H2125)t1415?m0s1
MFCD20755224
ZINC000006274987
ZINC000015987408
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