Vitas-M small molecule compound

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

Catalog ID
STK528680
SMILES O=c1sc(c([n-]1)[n+]1ccc(c(c1)C)C)/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/c1-11-5-8-22(10-12(11)2)15-14(25-17(24)20-15)9-19-21-16(23)13-3-6-18-7-4-13/h3-10H,1-2H3,(H-,18,19,20,21,23,24)
InChIKey
WZTZUPLIFJWSEG-UHFFFAOYSA-N
Synonyms
369609-09-6
369609096
4(34dimethylpyridin1ium1yl)5((2isonicotinoylhydrazono)methyl)2oxothiazol3ide
4(34DIMETHYLPYRIDIN1IUM1YL)5((E)(PYRIDINE4CARBONYLHYDRAZINYLIDENE)METHYL)13THIAZOL2OLATE
4(34DIMETHYLPYRIDIN1IUM1YL)5((PYRIDINE4CARBONYLHYDRAZINYLIDENE)METHYL)13THIAZOL2OLATE
4(34DIMETHYLPYRIDIN1IUM1YL)5((Z)(PYRIDINE4CARBONYLHYDRAZINYLIDENE)METHYL)13THIAZOL2OLATE
4(34dimethylpyridinium1yl)2oxo5((E)(2(pyridin4ylcarbonyl)hydrazinylidene)methyl)13thiazol3ide
CC1=C(C=(N+)(C=C1)C2=C(SC(=N2)(O))C=NNC(=O)C3=CC=NC=C3)C
InChI=1SC17H15N5O2Sc1115822(1012(11)2)1514(2517(24)2015)9192116(23)1336187413h310H12H3(H181920212324)
MFCD00785093
O=c1sc(c((n)1)(n+)1ccc(c(c1)C)C)C=NNC(=O)c1ccncc1
ZINC000006167678

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Available files

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