Vitas-M small molecule compound

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

Catalog ID
STK565679
SMILES COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccn1

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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 C15H13N5OS MW 311.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5OS/c1-21-13-7-5-11(6-8-13)14-18-19-15(22)20(14)17-10-12-4-2-3-9-16-12/h2-10H,1H3,(H,19,22)/b17-10+
InChIKey
CNZXRVVPTJGSEG-LICLKQGHSA-N
Synonyms
497083-02-0
3(4METHOXYPHENYL)4((E)PYRIDIN2YLMETHYLIDENEAMINO)1H124TRIAZOLE5THIONE
497083020
5(4methoxyphenyl)4(((E)pyridin2ylmethylidene)amino)24dihydro3H124triazole3thione
COc1ccc(cc1)c1n(nH)c(=S)n1N=Cc1ccccn1
InChI=1SC15H13N5OSc121137511(6813)14181915(22)20(14)17101242391612h210H1H3(H1922)b1710+
MFCD03801693
ZINC000001473622
ZINC04679467
ZINC4679467

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Available files

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