Vitas-M small molecule compound

4-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-5-(4-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK561877
SMILES COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1c(O)ccc2c1cccc2

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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 C20H16N4O2S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O2S/c1-26-15-9-6-14(7-10-15)19-22-23-20(27)24(19)21-12-17-16-5-3-2-4-13(16)8-11-18(17)25/h2-12,25H,1H3,(H,23,27)/b21-12+
InChIKey
SRZVXUIGGSFIPX-CIAFOILYSA-N
Synonyms
613231-58-6
4(((E)(2hydroxynaphthalen1yl)methylidene)amino)5(4methoxyphenyl)24dihydro3H124triazole3thione
613231586
COc1ccc(cc1)c1n(nH)c(=S)n1N=Cc1c(O)ccc2c1cccc2
MFCD03797440
ZINC000001478112

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Available files

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