Vitas-M small molecule compound
6-(2,2-diphenylethyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL284884
SMILES C1C2CC3CC1CC(C2)(C3)c1nnc2n1nc(s2)CC(c1ccccc1)c1ccccc1
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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 C27H28N4S MW 440.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4S/c1-3-7-21(8-4-1)23(22-9-5-2-6-10-22)14-24-30-31-25(28-29-26(31)32-24)27-15-18-11-19(16-27)13-20(12-18)17-27/h1-10,18-20,23H,11-17H2InChIKey
WGCWQVPZNCYJKR-UHFFFAOYSA-NSynonyms
3(1adamantyl)6(22diphenylethyl)(124)triazolo(34b)(134)thiadiazole
6(22diphenylethyl)3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN=C5N4N=C(S5)CC(C6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC27H28N4Sc13721(841)23(2295261022)1424303125(282926(31)3224)2715181119(1627)1320(1218)1727h110182023H1117H2
ZINC000095481702
ZINC95481702
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