Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-5-({[2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STK666429
SMILES COc1cc(ccc1OC)c1nnc(n1N)SCc1csc(n1)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 C24H29N5O2S2 MW 483.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O2S2/c1-30-19-4-3-17(8-20(19)31-2)21-27-28-23(29(21)25)33-13-18-12-32-22(26-18)24-9-14-5-15(10-24)7-16(6-14)11-24/h3-4,8,12,14-16H,5-7,9-11,13,25H2,1-2H3InChIKey
MIMHCUCGPSGDQZ-UHFFFAOYSA-NSynonyms
3((2(1adamantyl)13thiazol4yl)methylsulfanyl)5(34dimethoxyphenyl)124triazol4amine
3(34dimethoxyphenyl)5(((2(tricyclo(3311~37~)dec1yl)13thiazol4yl)methyl)sulfanyl)4H124triazol4amine
COC1=C(C=C(C=C1)C2=NN=C(N2N)SCC3=CSC(=N3)C45CC6CC(C4)CC(C6)C5)OC
InChI=1SC24H29N5O2S2c130194317(820(19)312)21272823(29(21)25)331318123222(2618)24914515(1024)716(614)1124h348121416H579111325H212H3
MFCD09763932
ZINC000015082811
ZINC15082811
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