Vitas-M small molecule compound

(2Z)-{(2E)-3-methyl-4-oxo-2-[2-(phenylcarbonyl)hydrazinylidene]-1,3-thiazolidin-5-ylidene}ethanoic acid

Catalog ID
STK527643
SMILES OC(=O)/C=C/1\S/C(=N/NC(=O)c2ccccc2)/N(C1=O)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 C13H11N3O4S MW 305.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O4S/c1-16-12(20)9(7-10(17)18)21-13(16)15-14-11(19)8-5-3-2-4-6-8/h2-7H,1H3,(H,14,19)(H,17,18)/b9-7-,15-13+
InChIKey
XAUNXROZKOIFAB-JCCJWXFJSA-N
Synonyms
372501-64-9
(2(BENZOYLHYDRAZONO)3METHYL4OXOTHIAZOLIDIN(5Z)YLIDENE)ACETICACID
(2Z)((2E)3methyl4oxo2(2(phenylcarbonyl)hydrazinylidene)13thiazolidin5ylidene)ethanoicacid
(2Z)2((2E)2(BENZOYLHYDRAZINYLIDENE)3METHYL4OXO13THIAZOLIDIN5YLIDENE)ACETICACID
(Z)2((E)2(2benzoylhydrazono)3methyl4oxothiazolidin5ylidene)aceticacid
372501649
CN1C(=O)C(=CC(=O)O)SC1=NNC(=O)C2=CC=CC=C2
InChI=1SC13H11N3O4Sc11612(20)9(710(17)18)2113(16)151411(19)8532468h27H1H3(H1419)(H1718)b971513+
MFCD01218438
OC(=O)C=C1SC(=NNC(=O)c2ccccc2)N(C1=O)C
ZINC000001205023
ZINC13638719

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Available files

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