Vitas-M small molecule compound

2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STL397142
SMILES Cc1nn(c(c1N1C(=O)c2c(C1=O)cccc2)C)c1ccc(cc1)[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 C19H14N4O4 MW 362.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N4O4/c1-11-17(21-18(24)15-5-3-4-6-16(15)19(21)25)12(2)22(20-11)13-7-9-14(10-8-13)23(26)27/h3-10H,1-2H3
InChIKey
ILJQWKQFMREFGM-UHFFFAOYSA-N
Synonyms
482573-78-4
2(1(4NITROPHENYL)35DIMETHYL1HPYRAZOL4YL)1HISOINDOLE13(2H)DIONE
2(35DIMETHYL1(4NITROPHENYL)1HPYRAZOL4YL)1HISOINDOLE13(2H)DIONE
2(35DIMETHYL1(4NITROPHENYL)PYRAZOL4YL)ISOINDOLE13DIONE
482573784
CC1=C(C(=NN1C2=CC=C(C=C2)(N+)(=O)(O))C)N3C(=O)C4=CC=CC=C4C3=O
Cc1nn(c(c1N1C(=O)c2c(C1=O)cccc2)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H14N4O4c11117(2118(24)15534616(15)19(21)25)12(2)22(2011)137914(10813)23(26)27h310H12H3
MFCD00851948
ZINC000000993841
ZINC00993841
ZINC993841

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Available files

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