Vitas-M small molecule compound

4-(3-ethylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide

Catalog ID
STL323993
SMILES CCc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccncc1

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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 C17H15N5O2S MW 353.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5O2S/c1-2-12-4-3-9-22(11-12)15-14(25-17(24)20-15)10-19-21-16(23)13-5-7-18-8-6-13/h3-11H,2H2,1H3,(H-,18,19,20,21,23,24)
InChIKey
RMTWZTIAQKIXMI-UHFFFAOYSA-N
Synonyms
324060-81-3
(E)4(3ethylpyridin1ium1yl)5((2isonicotinoylhydrazono)methyl)2oxothiazol3ide
324060813
4(3ethylpyridin1ium1yl)5((E)(pyridine4carbonylhydrazinylidene)methyl)13thiazol2olate
4(3ETHYLPYRIDIN1IUM1YL)5((PYRIDINE4CARBONYLHYDRAZINYLIDENE)METHYL)13THIAZOL2OLATE
4(3ETHYLPYRIDIN1IUM1YL)5((Z)(PYRIDINE4CARBONYLHYDRAZINYLIDENE)METHYL)13THIAZOL2OLATE
4(3ethylpyridinium1yl)2oxo5((E)(2(pyridin4ylcarbonyl)hydrazinylidene)methyl)13thiazol3ide
CCC1=C(N+)(=CC=C1)C2=C(SC(=N2)(O))C=NNC(=O)C3=CC=NC=C3
CCc1ccc(n+)(c1)c1(n)c(=O)sc1C=NNC(=O)c1ccncc1
InChI=1SC17H15N5O2Sc121243922(1112)1514(2517(24)2015)10192116(23)1357188613h311H2H21H3(H181920212324)
MFCD00779112
ZINC000013739398
ZINC00980184

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Available files

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