Vitas-M small molecule compound
2-phenyl-4-[3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]quinoline
Catalog ID
STL221407
SMILES c1ccc(cc1)c1nc2ccccc2c(c1)c1nn2c(s1)nnc2C12CC3CC(C2)CC(C1)C3
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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 C28H25N5S MW 463.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5S/c1-2-6-20(7-3-1)24-13-22(21-8-4-5-9-23(21)29-24)25-32-33-26(30-31-27(33)34-25)28-14-17-10-18(15-28)12-19(11-17)16-28/h1-9,13,17-19H,10-12,14-16H2InChIKey
GDRYGTSAQVRMLP-UHFFFAOYSA-NSynonyms
2phenyl4(3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazol6yl)quinoline
3(1adamantyl)6(2phenylquinolin4yl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN=C5N4N=C(S5)C6=CC(=NC7=CC=CC=C76)C8=CC=CC=C8
InChI=1SC28H25N5Sc12620(731)241322(21845923(21)2924)25323326(303127(33)3425)2814171018(1528)1219(1117)1628h19131719H10121416H2
ZINC000080346354
ZINC80346354
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