Vitas-M small molecule compound

3-methyl-5-oxo-5-[(2E)-1,3,4-thiadiazol-2(3H)-ylideneamino]pentanoic acid

Catalog ID
STK936774
SMILES CC(CC(=O)O)CC(=O)/N=c\1/scn[nH]1

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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 C8H11N3O3S MW 229.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11N3O3S/c1-5(3-7(13)14)2-6(12)10-8-11-9-4-15-8/h4-5H,2-3H2,1H3,(H,13,14)(H,10,11,12)
InChIKey
OWYYNESMEFQDQD-UHFFFAOYSA-N
Synonyms
684238-46-8
684238468
CC(CC(=O)O)CC(=O)N=c1scn(nH)1
MFCD18178457
ZINC000000099753
ZINC000000099756

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Available files

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