Vitas-M small molecule compound

4-chloro-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide

Catalog ID
STK425237
SMILES CCn1ncc(c1)CNC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

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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 C13H13ClN4O3 MW 308.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN4O3/c1-2-17-8-9(7-16-17)6-15-13(19)10-3-4-11(14)12(5-10)18(20)21/h3-5,7-8H,2,6H2,1H3,(H,15,19)
InChIKey
VLLSDYQLKYEMMK-UHFFFAOYSA-N
Synonyms
525577-17-7
(4CHLORO3NITROPHENYL)N((1ETHYLPYRAZOL4YL)METHYL)CARBOXAMIDE
4chloroN((1ethyl1Hpyrazol4yl)methyl)3nitrobenzamide
4CHLORON((1ETHYLPYRAZOL4YL)METHYL)3NITROBENZAMIDE
525577177
CCN1C=C(C=N1)CNC(=O)C2=CC(=C(C=C2)Cl)(N+)(=O)(O)
CCn1ncc(c1)CNC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC13H13ClN4O3c121789(71617)61513(19)103411(14)12(510)18(20)21h3578H26H21H3(H1519)
MFCD02375128
ZINC000000372994
ZINC00372994
ZINC372994

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Available files

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