Vitas-M small molecule compound

2-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

Catalog ID
STK156201
SMILES OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ncc(s1)[N+](=O)[O-]

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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 C12H5N3O6S MW 319.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H5N3O6S/c16-9-6-2-1-5(11(18)19)3-7(6)10(17)14(9)12-13-4-8(22-12)15(20)21/h1-4H,(H,18,19)
InChIKey
LZNJPFFFDSEXLN-UHFFFAOYSA-N
Synonyms

2(5NITRO13THIAZOL2YL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLICACID
2(5NITRO13THIAZOL2YL)13DIOXOISOINDOLE5CARBOXYLICACID
C1=CC2=C(C=C1C(=O)O)C(=O)N(C2=O)C3=NC=C(S3)(N+)(=O)(O)
InChI=1SC12H5N3O6Sc1696215(11(18)19)37(6)10(17)14(9)121348(2212)15(20)21h14H(H1819)
MFCD01137740
OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ncc(s1)(N+)(=O)(O)
ZINC000004695674
ZINC4695674

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Available files

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