Vitas-M small molecule compound

4-(2,4-dimethoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK150128
SMILES COc1ccc(c(c1)OC)n1c(S)nnc1c1ccncc1

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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 C15H14N4O2S MW 314.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O2S/c1-20-11-3-4-12(13(9-11)21-2)19-14(17-18-15(19)22)10-5-7-16-8-6-10/h3-9H,1-2H3,(H,18,22)
InChIKey
ACGCMIWROJHFIS-UHFFFAOYSA-N
Synonyms

4(24DIMETHOXYPHENYL)3PYRIDIN4YL1H124TRIAZOLE5THIONE
4(24DIMETHOXYPHENYL)5(4PYRIDYL)124TRIAZOLE3THIOL
4(24DIMETHOXYPHENYL)5(PYRIDIN4YL)4H124TRIAZOLE3THIOL
COC1=CC(=C(C=C1)N2C(=NNC2=S)C3=CC=NC=C3)OC
InChI=1SC15H14N4O2Sc120113412(13(911)212)1914(171815(19)22)1057168610h39H12H3(H1822)
MFCD03612905
ZINC000005910630
ZINC5910630

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Available files

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