Vitas-M small molecule compound

4-({[3-(4-methoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)benzene-1,3-diol

Catalog ID
STK101990
SMILES COc1ccc(cc1)c1nnc(n1/N=C\c1ccc(cc1O)O)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 C16H14N4O3S MW 342.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O3S/c1-23-13-6-3-10(4-7-13)15-18-19-16(24)20(15)17-9-11-2-5-12(21)8-14(11)22/h2-9,21-22H,1H3,(H,19,24)
InChIKey
CSHNWFXMPNGJFG-UHFFFAOYSA-N
Synonyms

(E)4(((3mercapto5(4methoxyphenyl)4H124triazol4yl)imino)methyl)benzene13diol
4(((3(4methoxyphenyl)5sulfanyl4H124triazol4yl)imino)methyl)benzene13diol
COc1ccc(cc1)c1nnc(n1N=Cc1ccc(cc1O)O)S
MFCD03217972
ZINC000252394265

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Available files

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