Vitas-M small molecule compound

4-(methylcarbamoyl)-1-{[(E)-(4-methylphenyl)methylidene]amino}-1H-1,2,3-triazol-5-olate

Catalog ID
STL437153
SMILES CNC(=O)c1nnn(c1[O-])/N=C/c1ccc(cc1)C

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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 C12H12N5O2 MW 258.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N5O2/c1-8-3-5-9(6-4-8)7-14-17-12(19)10(15-16-17)11(18)13-2/h3-7,19H,1-2H3,(H,13,18)/p-1/b14-7+
InChIKey
SVNWVNRORDBFAI-VGOFMYFVSA-M
Synonyms

4(methylcarbamoyl)1(((E)(4methylphenyl)methylidene)amino)1H123triazol5olate
CNC(=O)c1nnn(c1(O))N=Cc1ccc(cc1)C
ZINC000006009093

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Available files

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