Vitas-M small molecule compound
1-{[6-(3,5-di-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Catalog ID
STK500057
SMILES CC(c1cc(cc(c1)c1nn2c(s1)nnc2Cn1cnc2c1cccc2)C(C)(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 C25H28N6S MW 444.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6S/c1-24(2,3)17-11-16(12-18(13-17)25(4,5)6)22-29-31-21(27-28-23(31)32-22)14-30-15-26-19-9-7-8-10-20(19)30/h7-13,15H,14H2,1-6H3InChIKey
JKSDSAYJSXKHTM-UHFFFAOYSA-NSynonyms
1((6(35ditertbutylphenyl)(124)triazolo(34b)(134)thiadiazol3yl)methyl)1Hbenzimidazole
3(benzimidazol1ylmethyl)6(35ditertbutylphenyl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=CC(=CC(=C1)C2=NN3C(=NN=C3S2)CN4C=NC5=CC=CC=C54)C(C)(C)C
InChI=1SC25H28N6Sc124(23)171116(1218(1317)25(45)6)22293121(272823(31)3222)14301526199781020(19)30h71315H14H216H3
MFCD08728565
ZINC000008706336
ZINC08706336
ZINC8706336
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