Vitas-M small molecule compound

1-[(2E)-2-[(2E)-(2-chlorobenzylidene)hydrazinylidene]-4-methyl-1,3-thiazol-3(2H)-yl]ethanone

Catalog ID
STL437121
SMILES Clc1ccccc1/C=N/N=c\1/scc(n1C(=O)C)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 C13H12ClN3OS MW 293.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClN3OS/c1-9-8-19-13(17(9)10(2)18)16-15-7-11-5-3-4-6-12(11)14/h3-8H,1-2H3/b15-7+,16-13+
InChIKey
OQKPAJPEBVRIJL-HLVCTGTRSA-N
Synonyms

1((2E)2((2E)(2chlorobenzylidene)hydrazinylidene)4methyl13thiazol3(2H)yl)ethanone
1((2E)2((E)(2chlorophenyl)methylidenehydrazinylidene)4methyl13thiazol3yl)ethanone
CC1=CSC(=NN=CC2=CC=CC=C2Cl)N1C(=O)C
Clc1ccccc1C=NN=c1scc(n1C(=O)C)C
InChI=1SC13H12ClN3OSc1981913(17(9)10(2)18)1615711534612(11)14h38H12H3b157+1613+
MFCD06244740
ZINC000001409755
ZINC33337437

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Available files

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