Vitas-M small molecule compound
6-(4-tert-butylphenyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL193415
SMILES CC(c1ccc(cc1)c1sc2n(n1)c(nn2)C12CC3CC(C2)CC(C1)C3)(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 C23H28N4S MW 392.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4S/c1-22(2,3)18-6-4-17(5-7-18)19-26-27-20(24-25-21(27)28-19)23-11-14-8-15(12-23)10-16(9-14)13-23/h4-7,14-16H,8-13H2,1-3H3InChIKey
ROOCKNMOJBHYEW-UHFFFAOYSA-NSynonyms
3(1adamantyl)6(4tertbutylphenyl)(124)triazolo(34b)(134)thiadiazole
6(4tertbutylphenyl)3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C45CC6CC(C4)CC(C6)C5
InChI=1SC23H28N4Sc122(23)186417(5718)19262720(242521(27)2819)231114815(1223)1016(914)1323h471416H813H213H3
MFCD22391013
ZINC000072333531
ZINC72333531
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