Vitas-M small molecule compound

4-amino-5-(4-chlorobenzyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK519313
SMILES Clc1ccc(cc1)Cc1nnc(n1N)S

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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 C9H9ClN4S MW 240.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9ClN4S/c10-7-3-1-6(2-4-7)5-8-12-13-9(15)14(8)11/h1-4H,5,11H2,(H,13,15)
InChIKey
KXSQSDHGSAZIEO-UHFFFAOYSA-N
Synonyms
93073-15-5
4amino3((4chlorophenyl)methyl)1H124triazole5thione
4amino5(4chlorobenzyl)4H124triazole3thiol
93073155
C1=CC(=CC=C1CC2=NNC(=S)N2N)Cl
InChI=1SC9H9ClN4Sc107316(247)5812139(15)14(8)11h14H511H2(H1315)
MFCD10692307
ZINC000026475757
ZINC26475757

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Available files

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