Vitas-M small molecule compound

4-amino-5-[(4-chloro-3-methylphenoxy)methyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STL374035
SMILES Clc1ccc(cc1C)OCc1nnc(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 C10H11ClN4OS MW 270.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11ClN4OS/c1-6-4-7(2-3-8(6)11)16-5-9-13-14-10(17)15(9)12/h2-4H,5,12H2,1H3,(H,14,17)
InChIKey
CHINMOARWFJATM-UHFFFAOYSA-N
Synonyms

4amino3((4chloro3methylphenoxy)methyl)1H124triazole5thione
4amino5((4chloro3methylphenoxy)methyl)4H124triazole3thiol
CC1=C(C=CC(=C1)OCC2=NNC(=S)N2N)Cl
InChI=1SC10H11ClN4OSc1647(238(6)11)1659131410(17)15(9)12h24H512H21H3(H1417)
MFCD13813598
ZINC000020447640
ZINC20447640

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Available files

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