Vitas-M small molecule compound
6-[(4-chlorophenoxy)methyl]-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL193458
SMILES Clc1ccc(cc1)OCc1nn2c(s1)nnc2C12CC3CC(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 C20H21ClN4OS MW 400.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4OS/c21-15-1-3-16(4-2-15)26-11-17-24-25-18(22-23-19(25)27-17)20-8-12-5-13(9-20)7-14(6-12)10-20/h1-4,12-14H,5-11H2InChIKey
JEVNWVMUWPSGPD-UHFFFAOYSA-NSynonyms
3(1adamantyl)6((4chlorophenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
6((4chlorophenoxy)methyl)3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN=C5N4N=C(S5)COC6=CC=C(C=C6)Cl
InChI=1SC20H21ClN4OSc21151316(4215)261117242518(222319(25)2717)20812513(920)714(612)1020h141214H511H2
MFCD22391053
ZINC000072333571
ZINC72333571
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