Vitas-M small molecule compound
3-(4-tert-butylphenyl)-6-[(E)-2-(2-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL099049
SMILES COc1ccccc1/C=C/c1nn2c(s1)nnc2c1ccc(cc1)C(C)(C)C
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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 C22H22N4OS MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS/c1-22(2,3)17-12-9-16(10-13-17)20-23-24-21-26(20)25-19(28-21)14-11-15-7-5-6-8-18(15)27-4/h5-14H,1-4H3/b14-11+InChIKey
WBYDKUUMUSLAJU-SDNWHVSQSA-NSynonyms
3(4tertbutylphenyl)6((E)2(2methoxyphenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C=CC4=CC=CC=C4OC
COc1ccccc1C=Cc1nn2c(s1)nnc2c1ccc(cc1)C(C)(C)C
InChI=1SC22H22N4OSc122(23)1712916(101317)2023242126(20)2519(2821)141115756818(15)274h514H14H3b1411+
MFCD05087719
ZINC000004361484
ZINC04361484
ZINC4361484
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