Vitas-M small molecule compound

zinc bis[3-(1,3-benzothiazol-2-ylamino)-3-oxopropanoate]

Catalog ID
STL337932
SMILES O=C(CC(=O)Nc1nc2c(s1)cccc2)O[Zn]OC(=O)CC(=O)Nc1nc2c(s1)cccc2

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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 C20H14N4O6S2Zn MW 535.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/2C10H8N2O3S.Zn/c2*13-8(5-9(14)15)12-10-11-6-3-1-2-4-7(6)16-10;/h2*1-4H,5H2,(H,14,15)(H,11,12,13);/q;;+2/p-2
InChIKey
ATNNICUXNPYNOG-UHFFFAOYSA-L
Synonyms

C1=CC=C2C(=C1)N=C(S2)NC(=O)CC(=O)(O)C1=CC=C2C(=C1)N=C(S2)NC(=O)CC(=O)(O)(Zn+2)
InChI=1S2C10H8N2O3SZnc2*138(59(14)15)121011631247(6)1610h2*14H5H2(H1415)(H111213)q+2p2
MFCD01086593
O=C(CC(=O)Nc1nc2c(s1)cccc2)O(Zn)OC(=O)CC(=O)Nc1nc2c(s1)cccc2
zinc3(13benzothiazol2ylamino)3oxopropanoate
zincbis(3(13benzothiazol2ylamino)3oxopropanoate)

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Available files

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