Vitas-M small molecule compound

3-{4-(4-bromophenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine

Catalog ID
STK550459
SMILES Brc1ccc(cc1)n1c(nnc1c1cccnc1)SCc1c(Cl)cccc1Cl

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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 C20H13BrCl2N4S MW 492.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrCl2N4S/c21-14-6-8-15(9-7-14)27-19(13-3-2-10-24-11-13)25-26-20(27)28-12-16-17(22)4-1-5-18(16)23/h1-11H,12H2
InChIKey
FWGOTUQGZVXNJY-UHFFFAOYSA-N
Synonyms
477329-50-3
3((26DICHLOROPHENYL)METHYLTHIO)4(4BROMOPHENYL)5(3PYRIDYL)124TRIAZOLE
3(4(4BROMOPHENYL)5(((26DICHLOROPHENYL)METHYL)SULFANYL)4H124TRIAZOL3YL)PYRIDINE
3(4(4bromophenyl)5((26dichlorobenzyl)sulfanyl)4H124triazol3yl)pyridine
3(4(4BROMOPHENYL)5((26DICHLOROBENZYL)THIO)4H124TRIAZOL3YL)PYRIDINE
3(4(4BROMOPHENYL)5((26DICHLOROPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PYRIDINE
477329503
C1=CC(=C(C(=C1)Cl)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CN=CC=C4)Cl
InChI=1SC20H13BrCl2N4Sc21146815(9714)2719(133210241113)252620(27)28121617(22)41518(16)23h111H12H2
MFCD03474676
ZINC000001824586
ZINC01824586
ZINC1824586

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Available files

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