Vitas-M small molecule compound

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

Catalog ID
STK560668
SMILES CC(c1ccc(cc1)/C=N/n1c(n[nH]c1=S)C1CCCCC1)(C)C

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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 C19H26N4S MW 342.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4S/c1-19(2,3)16-11-9-14(10-12-16)13-20-23-17(21-22-18(23)24)15-7-5-4-6-8-15/h9-13,15H,4-8H2,1-3H3,(H,22,24)/b20-13+
InChIKey
GBJYULADQNTVHK-DEDYPNTBSA-N
Synonyms
488107-25-1
4(((E)(4tertbutylphenyl)methylidene)amino)5cyclohexyl24dihydro3H124triazole3thione
4((E)(4TERTBUTYLPHENYL)METHYLIDENEAMINO)3CYCLOHEXYL1H124TRIAZOLE5THIONE
488107251
CC(c1ccc(cc1)C=Nn1c(n(nH)c1=S)C1CCCCC1)(C)C
InChI=1SC19H26N4Sc119(23)1611914(101216)13202317(212218(23)24)157546815h91315H48H213H3(H2224)b2013+
MFCD03810859
ZINC000006781513
ZINC02328562
ZINC2328562

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Available files

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