Vitas-M small molecule compound

ethyl 2-amino-5-cyano-6-[(2,4-dinitrophenyl)sulfanyl]pyridine-3-carboxylate

Catalog ID
STK369936
SMILES CCOC(=O)c1cc(C#N)c(nc1N)Sc1ccc(cc1[N+](=O)[O-])[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 C15H11N5O6S MW 389.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N5O6S/c1-2-26-15(21)10-5-8(7-16)14(18-13(10)17)27-12-4-3-9(19(22)23)6-11(12)20(24)25/h3-6H,2H2,1H3,(H2,17,18)
InChIKey
QJRWGPGWYXJJGX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))N
CCOC(=O)c1cc(C#N)c(nc1N)Sc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
ethyl2amino5cyano6((24dinitrophenyl)sulfanyl)pyridine3carboxylate
ETHYL2AMINO5CYANO6(24DINITROPHENYL)SULFANYLPYRIDINE3CARBOXYLATE
InChI=1SC15H11N5O6Sc122615(21)1058(716)14(1813(10)17)2712439(19(22)23)611(12)20(24)25h36H2H21H3(H21718)
MFCD00353538
ZINC000022611734
ZINC22611734

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Available files

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