Vitas-M small molecule compound
2-[3-(3-chloro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]-5-(4-methoxybenzyl)-1,3,4-oxadiazole
Catalog ID
STL177896
SMILES COc1ccc(cc1)Cc1nnc(o1)C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)Cl
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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 C22H24ClN5O2 MW 425.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O2/c1-29-17-4-2-14(3-5-17)7-18-25-26-19(30-18)21-8-15-6-16(9-21)11-22(10-15,12-21)28-13-24-20(23)27-28/h2-5,13,15-16H,6-12H2,1H3InChIKey
IEQATZCHYMHGLN-UHFFFAOYSA-NSynonyms
832121-03-62(3(3chloro124triazol1yl)1adamantyl)5((4methoxyphenyl)methyl)134oxadiazole
2(3(3chloro1H124triazol1yl)tricyclo(3311~37~)dec1yl)5(4methoxybenzyl)134oxadiazole
832121036
COC1=CC=C(C=C1)CC2=NN=C(O2)C34CC5CC(C3)CC(C5)(C4)N6C=NC(=N6)Cl
InChI=1SC22H24ClN5O2c129174214(3517)718252619(3018)21815616(921)1122(10151221)28132420(23)2728h25131516H612H21H3
ZINC000002803675
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