Vitas-M small molecule compound

4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-cyclohexyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK564206
SMILES Clc1ccc(cc1)/C=N/n1c(=S)[nH]nc1C1CCCCC1

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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 C15H17ClN4S MW 320.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17ClN4S/c16-13-8-6-11(7-9-13)10-17-20-14(18-19-15(20)21)12-4-2-1-3-5-12/h6-10,12H,1-5H2,(H,19,21)/b17-10+
InChIKey
HUCLVAVFELXLDO-LICLKQGHSA-N
Synonyms
488108-38-9
4(((E)(4chlorophenyl)methylidene)amino)5cyclohexyl24dihydro3H124triazole3thione
4((E)(4CHLOROPHENYL)METHYLIDENEAMINO)3CYCLOHEXYL1H124TRIAZOLE5THIONE
488108389
Clc1ccc(cc1)C=Nn1c(=S)(nH)nc1C1CCCCC1
InChI=1SC15H17ClN4Sc16138611(7913)10172014(181915(20)21)124213512h61012H15H2(H1921)b1710+
MFCD03808282
ZINC000004898928
ZINC01308187
ZINC1308187

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Available files

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