Vitas-M small molecule compound

methyl 2-[({2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)amino]benzoate

Catalog ID
STK308292
SMILES COC(=O)c1ccccc1NC(=O)c1ccccc1Cn1nc(cc1C)[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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c1-13-11-18(24(27)28)22-23(13)12-14-7-3-4-8-15(14)19(25)21-17-10-6-5-9-16(17)20(26)29-2/h3-11H,12H2,1-2H3,(H,21,25)
InChIKey
UTPCFHCOKLHOKL-UHFFFAOYSA-N
Synonyms
1005586-27-5
1005586275
CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=CC=CC=C3C(=O)OC)(N+)(=O)(O)
COC(=O)c1ccccc1NC(=O)c1ccccc1Cn1nc(cc1C)(N+)(=O)(O)
InChI=1SC20H18N4O5c1131118(24(27)28)2223(13)1214734815(14)19(25)21171065916(17)20(26)292h311H12H212H3(H2125)
methyl2(((2((5methyl3nitro1Hpyrazol1yl)methyl)phenyl)carbonyl)amino)benzoate
METHYL2((2((5METHYL3NITROPYRAZOL1YL)METHYL)BENZOYL)AMINO)BENZOATE
MFCD04051000
ZINC000002796350
ZINC02796350
ZINC2796350

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Available files

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