Vitas-M small molecule compound
1-{[6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Catalog ID
STL221441
SMILES c1ccc2c(c1)n(cn2)Cc1nnc2n1nc(s2)C12CC3CC(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 C21H22N6S MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6S/c1-2-4-17-16(3-1)22-12-26(17)11-18-23-24-20-27(18)25-19(28-20)21-8-13-5-14(9-21)7-15(6-13)10-21/h1-4,12-15H,5-11H2InChIKey
REYRKEVGOIUYLQ-UHFFFAOYSA-NSynonyms
1((6(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazol3yl)methyl)1Hbenzimidazole
6(1adamantyl)3(benzimidazol1ylmethyl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN5C(=NN=C5S4)CN6C=NC7=CC=CC=C76
InChI=1SC21H22N6Sc1241716(31)221226(17)111823242027(18)2519(2820)21813514(921)715(613)1021h141215H511H2
ZINC000080346511
ZINC80346511
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