Vitas-M small molecule compound

5-[(E)-{2-[3-(9H-carbazol-9-yl)propanoyl]hydrazinylidene}methyl]-4-(3-ethylpyridinium-1-yl)-2-oxo-1,3-thiazol-3-ide

Catalog ID
STK527645
SMILES CCc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)CCn1c2ccccc2c2c1cccc2

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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 C26H23N5O2S MW 469.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O2S/c1-2-18-8-7-14-30(17-18)25-23(34-26(33)28-25)16-27-29-24(32)13-15-31-21-11-5-3-9-19(21)20-10-4-6-12-22(20)31/h3-12,14,16-17H,2,13,15H2,1H3,(H-,27,28,29,32,33)
InChIKey
CTOPDRKAONZSSR-UHFFFAOYSA-N
Synonyms
459789-93-6
(E)5((2(3(9Hcarbazol9yl)propanoyl)hydrazono)methyl)4(3ethylpyridin1ium1yl)2oxothiazol3ide
459789936
5((3CARBAZOL9YLPROPANOYLHYDRAZINYLIDENE)METHYL)4(3ETHYLPYRIDIN1IUM1YL)13THIAZOL2OLATE
5((E)(2(3(9Hcarbazol9yl)propanoyl)hydrazinylidene)methyl)4(3ethylpyridinium1yl)2oxo13thiazol3ide
5((E)(3CARBAZOL9YLPROPANOYLHYDRAZINYLIDENE)METHYL)4(3ETHYLPYRIDIN1IUM1YL)13THIAZOL2OLATE
5((Z)(3CARBAZOL9YLPROPANOYLHYDRAZINYLIDENE)METHYL)4(3ETHYLPYRIDIN1IUM1YL)13THIAZOL2OLATE
CCC1=C(N+)(=CC=C1)C2=C(SC(=N2)(O))C=NNC(=O)CCN3C4=CC=CC=C4C5=CC=CC=C53
CCc1ccc(n+)(c1)c1(n)c(=O)sc1C=NNC(=O)CCn1c2ccccc2c2c1cccc2
InChI=1SC26H23N5O2Sc1218871430(1718)2523(3426(33)2825)16272924(32)131531211153919(21)2010461222(20)31h312141617H21315H21H3(H2728293233)
MFCD01176668
ZINC000015985272
ZINC15985274

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Available files

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