Vitas-M small molecule compound

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

Catalog ID
STK555349
SMILES Cc1ccc(cc1)c1nnc2n1nc(s2)C1CCCCC1

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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 C16H18N4S MW 298.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4S/c1-11-7-9-12(10-8-11)14-17-18-16-20(14)19-15(21-16)13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3
InChIKey
OFQVFVZMFHZMEQ-UHFFFAOYSA-N
Synonyms
840516-91-8
6cyclohexyl3(4methylphenyl)(124)triazolo(34b)(134)thiadiazole
6CYCLOHEXYL3(4METHYLPHENYL)124TRIAZOLO(34B)134THIADIAZOLINE
6cyclohexyl3(ptolyl)(124)triazolo(34b)(134)thiadiazole
840516918
CC1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4CCCCC4
InChI=1SC16H18N4Sc1117912(10811)1417181620(14)1915(2116)135324613h71013H26H21H3
MFCD04010639
ZINC000000525343
ZINC00525343
ZINC525343

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.