Vitas-M small molecule compound
2-{3-[3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STL221402
SMILES O=C1N(CCCc2sc3n(n2)c(nn3)C23CC4CC(C3)CC(C2)C4)C(=O)c2c1cccc2
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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 C24H25N5O2S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O2S/c30-20-17-4-1-2-5-18(17)21(31)28(20)7-3-6-19-27-29-22(25-26-23(29)32-19)24-11-14-8-15(12-24)10-16(9-14)13-24/h1-2,4-5,14-16H,3,6-13H2InChIKey
QZUZSHIGDCGUIA-UHFFFAOYSA-NSynonyms
2(3(3(1adamantyl)(124)triazolo(34b)(134)thiadiazol6yl)propyl)isoindole13dione
2(3(3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazol6yl)propyl)1Hisoindole13(2H)dione
C1C2CC3CC1CC(C2)(C3)C4=NN=C5N4N=C(S5)CCCN6C(=O)C7=CC=CC=C7C6=O
InChI=1SC24H25N5O2Sc302017412518(17)21(31)28(20)73619272922(252623(29)3219)241114815(1224)1016(914)1324h12451416H3613H2
ZINC000080346333
ZINC80346333
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