Vitas-M small molecule compound

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

Catalog ID
STL039714
SMILES Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Cl)Cl

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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 C15H8Cl4N4S MW 418.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8Cl4N4S/c16-9-2-3-10(12(18)6-9)14-21-22-15(24)23(14)20-7-8-1-4-11(17)13(19)5-8/h1-7H,(H,22,24)/b20-7+
InChIKey
FSYBTMRFJHXAIQ-IFRROFPPSA-N
Synonyms
430451-80-2
3(24dichlorophenyl)4((E)(34dichlorophenyl)methylideneamino)1H124triazole5thione
430451802
5(24dichlorophenyl)4(((E)(34dichlorophenyl)methylidene)amino)24dihydro3H124triazole3thione
Clc1ccc(c(c1)Cl)c1n(nH)c(=S)n1N=Cc1ccc(c(c1)Cl)Cl
InChI=1SC15H8Cl4N4Sc1692310(12(18)69)14212215(24)23(14)20781411(17)13(19)58h17H(H2224)b207+
MFCD03799537
ZINC000008837172
ZINC12464587

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Available files

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