Vitas-M small molecule compound

3-cyclohexyl-6-(2,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL299556
SMILES COc1cc(OC)c(cc1c1nn2c(s1)nnc2C1CCCCC1)OC

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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 C18H22N4O3S MW 374.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O3S/c1-23-13-10-15(25-3)14(24-2)9-12(13)17-21-22-16(19-20-18(22)26-17)11-7-5-4-6-8-11/h9-11H,4-8H2,1-3H3
InChIKey
SMXDSFKCGCQAEX-UHFFFAOYSA-N
Synonyms
586992-65-6
1(3CYCLOHEXYL(124TRIAZOLO(34B)134THIADIAZOLIN6YL))245TRIMETHOXYBENZENE
3cyclohexyl6(245trimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
586992656
6ASARYL3CYCLOHEXYL(124)TRIAZOLO(34B)(134)THIADIAZOLE
COC1=CC(=C(C=C1C2=NN3C(=NN=C3S2)C4CCCCC4)OC)OC
InChI=1SC18H22N4O3Sc123131015(253)14(242)912(13)17212216(192018(22)2617)117546811h911H48H213H3
MFCD04032098
ZINC000002395154
ZINC02395154
ZINC2395154

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Available files

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