Vitas-M small molecule compound

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

Catalog ID
STK283795
SMILES COc1ccc(cc1CNn1c(C)nnc1S)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 C11H13ClN4OS MW 284.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13ClN4OS/c1-7-14-15-11(18)16(7)13-6-8-5-9(12)3-4-10(8)17-2/h3-5,13H,6H2,1-2H3,(H,15,18)
InChIKey
XZNFLPQRGXXEOW-UHFFFAOYSA-N
Synonyms

4((5chloro2methoxybenzyl)amino)5methyl4H124triazole3thiol
4((5CHLORO2METHOXYPHENYL)METHYLAMINO)3METHYL1H124TRIAZOLE5THIONE
CC1=NNC(=S)N1NCC2=C(C=CC(=C2)Cl)OC
InChI=1SC11H13ClN4OSc17141511(18)16(7)136859(12)3410(8)172h3513H6H212H3(H1518)
MFCD07363028
ZINC000004842695
ZINC04842695
ZINC4842695

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Available files

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