Vitas-M small molecule compound

3-cyclopropyl-5-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-propyl-4H-1,2,4-triazole

Catalog ID
STK445755
SMILES CCCn1c(SCc2csc(n2)c2cccc(c2)C)nnc1C1CC1

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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 C19H22N4S2 MW 370.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4S2/c1-3-9-23-17(14-7-8-14)21-22-19(23)25-12-16-11-24-18(20-16)15-6-4-5-13(2)10-15/h4-6,10-11,14H,3,7-9,12H2,1-2H3
InChIKey
PSZUDTDXAAKBHP-UHFFFAOYSA-N
Synonyms

3cyclopropyl5(((2(3methylphenyl)13thiazol4yl)methyl)sulfanyl)4propyl4H124triazole
4((5cyclopropyl4propyl124triazol3yl)sulfanylmethyl)2(3methylphenyl)13thiazole
5CYCLOPROPYL3((2(3METHYLPHENYL)(13THIAZOL4YL))METHYLTHIO)4PROPYL124TRIAZOLE
CCCN1C(=NN=C1SCC2=CSC(=N2)C3=CC(=CC=C3)C)C4CC4
InChI=1SC19H22N4S2c1392317(147814)212219(23)251216112418(2016)1564513(2)1015h46101114H37912H212H3
MFCD04055999
ZINC000006400371
ZINC06400371
ZINC6400371

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Available files

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