Vitas-M small molecule compound

5-[(2,4-dinitrobenzyl)sulfanyl]-1H-1,2,4-triazol-3-amine

Catalog ID
STL507821
SMILES Nc1n[nH]c(n1)SCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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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 C9H8N6O4S MW 296.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N6O4S/c10-8-11-9(13-12-8)20-4-5-1-2-6(14(16)17)3-7(5)15(18)19/h1-3H,4H2,(H3,10,11,12,13)
InChIKey
UJVJYFUXELAXNM-UHFFFAOYSA-N
Synonyms

3((24dinitrophenyl)methylsulfanyl)1~(H)124triazol5amine
5((24dinitrobenzyl)sulfanyl)1H124triazol3amine
66223501
InChI=1SC9H8N6O4Sc108119(13128)2045126(14(16)17)37(5)15(18)19h13H4H2(H310111213)
MFCD31615201
ZINC000090359949

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Available files

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