Vitas-M small molecule compound

4-(2-ethylphenyl)-5-methyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK444599
SMILES CCc1ccccc1n1c(C)nnc1S

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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 C11H13N3S MW 219.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3S/c1-3-9-6-4-5-7-10(9)14-8(2)12-13-11(14)15/h4-7H,3H2,1-2H3,(H,13,15)
InChIKey
DBEPXHARNHULQP-UHFFFAOYSA-N
Synonyms
669755-34-4
4(2ethylphenyl)3methyl1H124triazole5thione
4(2ETHYLPHENYL)5METHYL124TRIAZOLE3THIOL
4(2ethylphenyl)5methyl4H124triazole3thiol
669755344
CCC1=CC=CC=C1N2C(=NNC2=S)C
InChI=1SC11H13N3Sc139645710(9)148(2)121311(14)15h47H3H212H3(H1315)
MFCD04057519
ZINC000006395273
ZINC06395273
ZINC6395273

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Available files

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