Vitas-M small molecule compound

methyl 2-{[(3-nitro-1H-pyrazol-1-yl)acetyl]amino}benzoate

Catalog ID
STK778761
SMILES COC(=O)c1ccccc1NC(=O)Cn1ccc(n1)[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 C13H12N4O5 MW 304.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O5/c1-22-13(19)9-4-2-3-5-10(9)14-12(18)8-16-7-6-11(15-16)17(20)21/h2-7H,8H2,1H3,(H,14,18)
InChIKey
QLKGESWLEQCVSR-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=CC=C1NC(=O)CN2C=CC(=N2)(N+)(=O)(O)
COC(=O)c1ccccc1NC(=O)Cn1ccc(n1)(N+)(=O)(O)
InChI=1SC13H12N4O5c12213(19)9423510(9)1412(18)8167611(1516)17(20)21h27H8H21H3(H1418)
methyl2(((3nitro1Hpyrazol1yl)acetyl)amino)benzoate
METHYL2((2(3NITROPYRAZOL1YL)ACETYL)AMINO)BENZOATE
METHYL2(2(3NITROPYRAZOLYL)ACETYLAMINO)BENZOATE
MFCD05857081
ZINC000001069104
ZINC01069104
ZINC1069104

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Available files

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