Vitas-M small molecule compound

3-{[(2E)-6-(methoxycarbonyl)-1,3-benzothiazol-2(3H)-ylidene]carbamoyl}pyrazine-2-carboxylic acid

Catalog ID
STL246847
SMILES COC(=O)c1ccc2c(c1)s/c(=N/C(=O)c1nccnc1C(=O)O)/[nH]2

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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 C15H10N4O5S MW 358.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N4O5S/c1-24-14(23)7-2-3-8-9(6-7)25-15(18-8)19-12(20)10-11(13(21)22)17-5-4-16-10/h2-6H,1H3,(H,21,22)(H,18,19,20)
InChIKey
IPYZVMSRZAKSNP-UHFFFAOYSA-N
Synonyms
1324085-19-9
3(((2E)6(methoxycarbonyl)13benzothiazol2(3H)ylidene)carbamoyl)pyrazine2carboxylicacid
COC(=O)c1ccc2c(c1)sc(=NC(=O)c1nccnc1C(=O)O)(nH)2
MFCD24860696
ZINC000071279082

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Available files

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